N-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
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![N-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/7c56d262a3ea4fcba85dabeba58d6259.png "N-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide")
N-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
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CAS No:
799825-62-0
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Formula:
C21H18N4O2S2
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Chemical Name:
N-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
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Synonyms:
N-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide;N-[[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-sulfanylidenemethyl]-5-methyl-3-phenyl-4-isoxazolecarboxamide;SMR000218729;MLS000591704;CHEMBL1425659;CHEBI:121764;HMS2604A21;ZINC2238987;STK547518;AKOS005475770;MCULE-7903165499;CID 1869844;Q27210333;1-(3-Cyano-4,5,6,7-tetrahydro-benzo[b]thiophen-2-yl)-3-(5-methyl-3-phenyl-isoxazole-4-carbonyl)-thiourea;799825-62-0
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CAS No:
Description
N-[[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-sulfanylidenemethyl]-5-methyl-3-phenyl-4-isoxazolecarboxamide is a member of benzenes.
N-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide Basic Attributes
422.5 g/mol
422.08711818 g/mol
Computed Properties
Molecular Weight:422.5
XLogP3:5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:422.08711818
Monoisotopic Mass:422.08711818
Topological Polar Surface Area:151
Heavy Atom Count:29
Complexity:675
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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