Vitas-M small molecule compound
methyl 2-[({2-[(1,3-benzodioxol-5-yloxy)acetyl]hydrazinyl}carbonothioyl)amino]-4-ethyl-5-methylthiophene-3-carboxylate
Catalog ID
STK436700
SMILES COC(=O)c1c(NC(=S)NNC(=O)COc2ccc3c(c2)OCO3)sc(c1CC)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 C19H21N3O6S2 MW 451.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N3O6S2/c1-4-12-10(2)30-17(16(12)18(24)25-3)20-19(29)22-21-15(23)8-26-11-5-6-13-14(7-11)28-9-27-13/h5-7H,4,8-9H2,1-3H3,(H,21,23)(H2,20,22,29)InChIKey
QMMUQSBZSUDGHF-UHFFFAOYSA-NSynonyms
CCC1=C(SC(=C1C(=O)OC)NC(=S)NNC(=O)COC2=CC3=C(C=C2)OCO3)C
InChI=1SC19H21N3O6S2c141210(2)3017(16(12)18(24)253)2019(29)222115(23)82611561314(711)2892713h57H489H213H3(H2123)(H2202229)
METHYL2((((2(2HBENZO(34D)13DIOXOLAN5YLOXY)ACETYLAMINO)AMINO)THIOXOMETHYL)AMINO)4ETHYL5METHYLTHIOPHENE3CARBOXYLATE
methyl2(((2((13benzodioxol5yloxy)acetyl)hydrazinyl)carbonothioyl)amino)4ethyl5methylthiophene3carboxylate
METHYL2(((2(13BENZODIOXOL5YLOXY)ACETYL)AMINO)CARBAMOTHIOYLAMINO)4ETHYL5METHYLTHIOPHENE3CARBOXYLATE
MFCD03945118
ZINC000020191490
ZINC20191490
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