Vitas-M small molecule compound
methyl 2-[({2-[(1,3-benzodioxol-5-yloxy)acetyl]hydrazinyl}carbonothioyl)amino]-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STK437291
SMILES COC(=O)c1c(NC(=S)NNC(=O)COc2ccc3c(c2)OCO3)sc(c1C)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 C18H19N3O6S2 MW 437.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O6S2/c1-9-10(2)29-16(15(9)17(23)24-3)19-18(28)21-20-14(22)7-25-11-4-5-12-13(6-11)27-8-26-12/h4-6H,7-8H2,1-3H3,(H,20,22)(H2,19,21,28)InChIKey
SJJFBHHSMKGYIH-UHFFFAOYSA-NSynonyms
CC1=C(SC(=C1C(=O)OC)NC(=S)NNC(=O)COC2=CC3=C(C=C2)OCO3)C
InChI=1SC18H19N3O6S2c1910(2)2916(15(9)17(23)243)1918(28)212014(22)72511451213(611)2782612h46H78H213H3(H2022)(H2192128)
METHYL2((((2(2HBENZO(34D)13DIOXOLAN5YLOXY)ACETYLAMINO)AMINO)THIOXOMETHYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
methyl2(((2((13benzodioxol5yloxy)acetyl)hydrazinyl)carbonothioyl)amino)45dimethylthiophene3carboxylate
METHYL2(((2(13BENZODIOXOL5YLOXY)ACETYL)AMINO)CARBAMOTHIOYLAMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
MFCD03944884
ZINC000017101405
ZINC17101405
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