Vitas-M small molecule compound
2-[(4-methyl-3-nitrophenyl)carbonyl]-N-(4-methyl-2-oxo-2H-chromen-7-yl)hydrazinecarbothioamide
Catalog ID
STK470158
SMILES S=C(Nc1ccc2c(c1)oc(=O)cc2C)NNC(=O)c1ccc(c(c1)[N+](=O)[O-])C
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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 C19H16N4O5S MW 412.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N4O5S/c1-10-3-4-12(8-15(10)23(26)27)18(25)21-22-19(29)20-13-5-6-14-11(2)7-17(24)28-16(14)9-13/h3-9H,1-2H3,(H,21,25)(H2,20,22,29)InChIKey
OGKUQKSAVMMFDB-UHFFFAOYSA-NSynonyms
(4METHYL3NITROPHENYL)N((((4METHYL2OXOCHROMEN7YL)AMINO)THIOXOMETHYL)AMINO)CARBOXAMIDE
1((4METHYL3NITROBENZOYL)AMINO)3(4METHYL2OXOCHROMEN7YL)THIOUREA
2((4methyl3nitrophenyl)carbonyl)N(4methyl2oxo2Hchromen7yl)hydrazinecarbothioamide
CC1=C(C=C(C=C1)C(=O)NNC(=S)NC2=CC3=C(C=C2)C(=CC(=O)O3)C)(N+)(=O)(O)
InChI=1SC19H16N4O5Sc1103412(815(10)23(26)27)18(25)212219(29)2013561411(2)717(24)2816(14)913h39H12H3(H2125)(H2202229)
MFCD05083765
S=C(Nc1ccc2c(c1)oc(=O)cc2C)NNC(=O)c1ccc(c(c1)(N+)(=O)(O))C
ZINC000005041231
ZINC05041231
ZINC5041231
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