Vitas-M small molecule compound
2-[3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propanoyl]-N-(3-methoxyphenyl)hydrazinecarbothioamide
Catalog ID
STK302342
SMILES COc1cccc(c1)NC(=S)NNC(=O)CCn1nc(c(c1C)[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 C16H20N6O4S MW 392.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N6O4S/c1-10-15(22(24)25)11(2)21(20-10)8-7-14(23)18-19-16(27)17-12-5-4-6-13(9-12)26-3/h4-6,9H,7-8H2,1-3H3,(H,18,23)(H2,17,19,27)InChIKey
YRJSLQLTQIWPMA-UHFFFAOYSA-NSynonyms
512823-13-11(3(35DIMETHYL4NITROPYRAZOL1YL)PROPANOYLAMINO)3(3METHOXYPHENYL)THIOUREA
2(3(35dimethyl4nitro1Hpyrazol1yl)propanoyl)N(3methoxyphenyl)hydrazinecarbothioamide
2(3(4NITRO35DIMETHYL1HPYRAZOL1YL)PROPANOYL)N(3METHOXYPHENYL)HYDRAZINECARBOTHIOAMIDE
512823131
CC1=C(C(=NN1CCC(=O)NNC(=S)NC2=CC(=CC=C2)OC)C)(N+)(=O)(O)
COc1cccc(c1)NC(=S)NNC(=O)CCn1nc(c(c1C)(N+)(=O)(O))C
InChI=1SC16H20N6O4Sc11015(22(24)25)11(2)21(2010)8714(23)181916(27)171254613(912)263h469H78H213H3(H1823)(H2171927)
MFCD03468333
ZINC000002735362
ZINC02735362
ZINC2735362
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