Vitas-M small molecule compound
ethyl 5-acetyl-2-({[2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]carbonyl}amino)-4-methylthiophene-3-carboxylate
Catalog ID
STK955770
SMILES CCOC(=O)c1c(NC(=O)N/N=C/c2ccc3c(c2)OCO3)sc(c1C)C(=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 C19H19N3O6S MW 417.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O6S/c1-4-26-18(24)15-10(2)16(11(3)23)29-17(15)21-19(25)22-20-8-12-5-6-13-14(7-12)28-9-27-13/h5-8H,4,9H2,1-3H3,(H2,21,22,25)InChIKey
QQAWHORPDHUEOR-UHFFFAOYSA-NSynonyms
(E)ethyl5acetyl2(2(benzo(d)(13)dioxol5ylmethylene)hydrazinecarboxamido)4methylthiophene3carboxylate
CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)NN=CC2=CC3=C(C=C2)OCO3
CCOC(=O)c1c(NC(=O)NN=Cc2ccc3c(c2)OCO3)sc(c1C)C(=O)C
ETHYL2((N((1E)2(2HBENZO(34D)13DIOXOLAN5YL)1AZAVINYL)CARBAMOYL)AMINO)5ACETYL4METHYLTHIOPHENE3CARBOXYLATE
ethyl5acetyl2(((2(13benzodioxol5ylmethylidene)hydrazinyl)carbonyl)amino)4methylthiophene3carboxylate
ethyl5acetyl2((13benzodioxol5ylmethylideneamino)carbamoylamino)4methylthiophene3carboxylate
InChI=1SC19H19N3O6Sc142618(24)1510(2)16(11(3)23)2917(15)2119(25)2220812561314(712)2892713h58H49H213H3(H2212225)
MFCD01462767
ZINC000012413665
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