Vitas-M small molecule compound
4-{[(E)-(4-chloro-3-nitrophenyl)methylidene]amino}-5-(5-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL051129
SMILES Cc1[nH]nc(c1)c1nnc(n1/N=C/c1ccc(c(c1)[N+](=O)[O-])Cl)S
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C13H10ClN7O2S MW 363.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H10ClN7O2S/c1-7-4-10(17-16-7)12-18-19-13(24)20(12)15-6-8-2-3-9(14)11(5-8)21(22)23/h2-6H,1H3,(H,16,17)(H,19,24)/b15-6+InChIKey
VDCKSZZWECWFSY-GIDUJCDVSA-NSynonyms
1035066-95-5(E)4((4chloro3nitrobenzylidene)amino)5(3methyl1Hpyrazol5yl)4H124triazole3thiol
1035066955
4(((E)(4chloro3nitrophenyl)methylidene)amino)5(5methyl1Hpyrazol3yl)4H124triazole3thiol
4((1(4CHLORO3NITROPHENYL)METH(E)YLIDENE)AMINO)5(5METHYL2HPYRAZOL3YL)4H(124)TRIAZOLE3THIOL
4((1E)2(4CHLORO3NITROPHENYL)1AZAVINYL)5(3METHYLPYRAZOL5YL)124TRIAZOLE3THIOL
4((E)(4CHLORO3NITROPHENYL)METHYLIDENEAMINO)3(5METHYL1HPYRAZOL3YL)1H124TRIAZOLE5THIONE
Cc1(nH)nc(c1)c1nnc(n1N=Cc1ccc(c(c1)(N+)(=O)(O))Cl)S
CC1=CC(=NN1)C2=NNC(=S)N2N=CC3=CC(=C(C=C3)Cl)(N+)(=O)(O)
Cc1n(nH)c(c1)c1nnc(n1N=Cc1ccc(c(c1)(N+)(=O)(O))Cl)S
InChI=1SC13H10ClN7O2Sc17410(17167)12181913(24)20(12)1568239(14)11(58)21(22)23h26H1H3(H1617)(H1924)b156+
MFCD05727040
ZINC000013144054
ZINC13144053
Check stock
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Check stock on Vitas-MAvailable files
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