2-[2,5-dimethyl-3-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]pyrrol-1-yl]-4,5-dimethylthiophene-3-carbonitrile
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![2-[2,5-dimethyl-3-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]pyrrol-1-yl]-4,5-dimethylthiophene-3-carbonitrile structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/2ddc2bc2eeca4967b404ae5a8fb7a131.png "2-[2,5-dimethyl-3-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]pyrrol-1-yl]-4,5-dimethylthiophene-3-carbonitrile")
2-[2,5-dimethyl-3-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]pyrrol-1-yl]-4,5-dimethylthiophene-3-carbonitrile
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CAS No:
371126-93-1
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Formula:
C18H16N4O3S
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Chemical Name:
2-[2,5-dimethyl-3-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]pyrrol-1-yl]-4,5-dimethylthiophene-3-carbonitrile
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Synonyms:
MLS000591328;SMR000218936;2-[2,5-Dimethyl-3-(2,4,6-trioxo-tetrahydro-pyrimidin-5-ylidenemethyl)-pyrrol-1-yl]-4,5-dimethyl-thiophene-3-carbonitrile;CHEMBL1399551;BDBM52474;cid_1930867;HMS2619P04;STK573025;ZINC16994178;AKOS005498283;AKOS030514196;MCULE-6959953475;2-[2,5-dimethyl-3-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]pyrrol-1-yl]-4,5-dimethylthiophene-3-carbonitrile;2-[2,5-dimethyl-3-[(2,4,6-triketohexahydropyrimidin-5-ylidene)methyl]pyrrol-1-yl]-4,5-dimethyl-thiophene-3-carbonitrile;2-[2,5-dimethyl-3-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-1-pyrrolyl]-4,5-dimethyl-3-thiophenecarbonitrile;2-[2,5-dimethyl-3-[[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methyl]pyrrol-1-yl]-4,5-dimethyl-thiophene-3-carbonitrile;2-{3-[(E)-(2,6-dihydroxy-4-oxopyrimidin-5(4H)-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}-4,5-dimethylthiophene-3-carbonitrile;371126-93-1
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CAS No:
2-[2,5-dimethyl-3-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]pyrrol-1-yl]-4,5-dimethylthiophene-3-carbonitrile Basic Attributes
368.4 g/mol
368.09431156 g/mol
Computed Properties
Molecular Weight:368.4
XLogP3:2.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:368.09431156
Monoisotopic Mass:368.09431156
Topological Polar Surface Area:132
Heavy Atom Count:26
Complexity:705
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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