Vitas-M small molecule compound
2-({[1-(4-methoxy-3-nitrobenzyl)-2-methyl-4-nitro-1H-imidazol-5-yl]sulfanyl}acetyl)-N-methylhydrazinecarbothioamide
Catalog ID
STL314425
SMILES CNC(=S)NNC(=O)CSc1c(nc(n1Cc1ccc(c(c1)[N+](=O)[O-])OC)C)[N+](=O)[O-]
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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 C16H19N7O6S2 MW 469.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N7O6S2/c1-9-18-14(23(27)28)15(31-8-13(24)19-20-16(30)17-2)21(9)7-10-4-5-12(29-3)11(6-10)22(25)26/h4-6H,7-8H2,1-3H3,(H,19,24)(H2,17,20,30)InChIKey
GFJOIUOZIVQAPK-UHFFFAOYSA-NSynonyms
330180-74-01((2(3((4METHOXY3NITROPHENYL)METHYL)2METHYL5NITROIMIDAZOL4YL)SULFANYLACETYL)AMINO)3METHYLTHIOUREA
2(((1(4methoxy3nitrobenzyl)2methyl4nitro1Himidazol5yl)sulfanyl)acetyl)Nmethylhydrazinecarbothioamide
2(2((1(4methoxy3nitrobenzyl)2methyl4nitro1Himidazol5yl)thio)acetyl)Nmethylhydrazinecarbothioamide
330180740
CC1=NC(=C(N1CC2=CC(=C(C=C2)OC)(N+)(=O)(O))SCC(=O)NNC(=S)NC)(N+)(=O)(O)
CNC(=S)NNC(=O)CSc1c(nc(n1Cc1ccc(c(c1)(N+)(=O)(O))OC)C)(N+)(=O)(O)
InChI=1SC16H19N7O6S2c191814(23(27)28)15(31813(24)192016(30)172)21(9)7104512(293)11(610)22(25)26h46H78H213H3(H1924)(H2172030)
MFCD00330642
ZINC000013282774
ZINC13282774
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