Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-[(4-methyl-3-nitrophenyl)carbonyl]hydrazinecarbothioamide
Catalog ID
STK456937
SMILES S=C(Nc1ccc2c(c1)OCO2)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 C16H14N4O5S MW 374.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N4O5S/c1-9-2-3-10(6-12(9)20(22)23)15(21)18-19-16(26)17-11-4-5-13-14(7-11)25-8-24-13/h2-7H,8H2,1H3,(H,18,21)(H2,17,19,26)InChIKey
NIUVKXPSINIVPC-UHFFFAOYSA-NSynonyms
1(13BENZODIOXOL5YL)3((4METHYL3NITROBENZOYL)AMINO)THIOUREA
CC1=C(C=C(C=C1)C(=O)NNC(=S)NC2=CC3=C(C=C2)OCO3)(N+)(=O)(O)
InChI=1SC16H14N4O5Sc192310(612(9)20(22)23)15(21)181916(26)1711451314(711)2582413h27H8H21H3(H1821)(H2171926)
MFCD04137219
N(((2HBENZO(34D)13DIOXOLAN5YLAMINO)THIOXOMETHYL)AMINO)(4METHYL3NITROPHENYL)CARBOXAMIDE
N(13benzodioxol5yl)2((4methyl3nitrophenyl)carbonyl)hydrazinecarbothioamide
N13BENZODIOXOL5YL2((4METHYL3NITROPHENYL)CARBONYL)HYDRAZINECARBOTHIOAMIDE
S=C(Nc1ccc2c(c1)OCO2)NNC(=O)c1ccc(c(c1)(N+)(=O)(O))C
ZINC000002855742
ZINC02855742
ZINC2855742
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