5-amino-1-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzoyl]pyrazole-4-carbonitrile
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![5-amino-1-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzoyl]pyrazole-4-carbonitrile structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/3110159972684ee3ac8ae6b6e278f960.png "5-amino-1-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzoyl]pyrazole-4-carbonitrile")
5-amino-1-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzoyl]pyrazole-4-carbonitrile
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CAS No:
909858-83-9
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Formula:
C15H13N7OS
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Chemical Name:
5-amino-1-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzoyl]pyrazole-4-carbonitrile
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Synonyms:
SMR000063201;MLS000057838;MLS002634440;CHEMBL1735074;BDBM41387;cid_2084089;REGID_for_CID_2084089;HMS1756I19;HMS2380F13;ZINC2622180;AKOS034444475;MCULE-2874743892;5-amino-1-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzoyl]pyrazole-4-carbonitrile;Z55185189;5-amino-1-[4-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]benzoyl]pyrazole-4-carbonitrile;5-amino-1-(4-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}benzoyl)-1H-pyrazole-4-carbonitrile;5-amino-1-[[4-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]phenyl]-oxomethyl]-4-pyrazolecarbonitrile;5-azanyl-1-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]carbonyl-pyrazole-4-carbonitrile;909858-83-9
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CAS No:
5-amino-1-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzoyl]pyrazole-4-carbonitrile Basic Attributes
339.4 g/mol
339.09022924 g/mol
Computed Properties
Molecular Weight:339.4
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:339.09022924
Monoisotopic Mass:339.09022924
Topological Polar Surface Area:141
Heavy Atom Count:24
Complexity:501
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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