Vitas-M small molecule compound
2-[2-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propanoyl]-N-(4-methyl-2-oxo-2H-chromen-7-yl)hydrazinecarbothioamide
Catalog ID
STK460584
SMILES COc1nn(cc1[N+](=O)[O-])C(C(=O)NNC(=S)Nc1ccc2c(c1)oc(=O)cc2C)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 C18H18N6O6S MW 446.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N6O6S/c1-9-6-15(25)30-14-7-11(4-5-12(9)14)19-18(31)21-20-16(26)10(2)23-8-13(24(27)28)17(22-23)29-3/h4-8,10H,1-3H3,(H,20,26)(H2,19,21,31)InChIKey
MCMRBPXVRRSZTQ-UHFFFAOYSA-NSynonyms
1(2(3METHOXY4NITROPYRAZOL1YL)PROPANOYLAMINO)3(4METHYL2OXOCHROMEN7YL)THIOUREA
2(2(3methoxy4nitro1Hpyrazol1yl)propanoyl)N(4methyl2oxo2Hchromen7yl)hydrazinecarbothioamide
2(3METHOXY4NITROPYRAZOLYL)N((((4METHYL2OXOCHROMEN7YL)AMINO)THIOXOMETHYL)AMINO)PROPANAMIDE
CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NNC(=O)C(C)N3C=C(C(=N3)OC)(N+)(=O)(O)
COc1nn(cc1(N+)(=O)(O))C(C(=O)NNC(=S)Nc1ccc2c(c1)oc(=O)cc2C)C
InChI=1SC18H18N6O6Sc19615(25)3014711(4512(9)14)1918(31)212016(26)10(2)23813(24(27)28)17(2223)293h4810H13H3(H2026)(H2192131)
MFCD05076164
ZINC000002855918
ZINC000002855919
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