Vitas-M small molecule compound
methyl 4-ethyl-2-({[4-(4-hydroxyphenyl)piperazin-1-yl]carbonothioyl}amino)-5-methylthiophene-3-carboxylate
Catalog ID
STK446372
SMILES COC(=O)c1c(NC(=S)N2CCN(CC2)c2ccc(cc2)O)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 C20H25N3O3S2 MW 419.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O3S2/c1-4-16-13(2)28-18(17(16)19(25)26-3)21-20(27)23-11-9-22(10-12-23)14-5-7-15(24)8-6-14/h5-8,24H,4,9-12H2,1-3H3,(H,21,27)InChIKey
LUXHDALGIPCQGA-UHFFFAOYSA-NSynonyms
CCC1=C(SC(=C1C(=O)OC)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)O)C
InChI=1SC20H25N3O3S2c141613(2)2818(17(16)19(25)263)2120(27)2311922(101223)145715(24)8614h5824H4912H213H3(H2127)
methyl4ethyl2(((4(4hydroxyphenyl)piperazin1yl)carbonothioyl)amino)5methylthiophene3carboxylate
METHYL4ETHYL2(((4(4HYDROXYPHENYL)PIPERAZINYL)THIOXOMETHYL)AMINO)5METHYLTHIOPHENE3CARBOXYLATE
methyl4ethyl2((4(4hydroxyphenyl)piperazine1carbothioyl)amino)5methylthiophene3carboxylate
MFCD04058763
ZINC000006394594
ZINC06394594
ZINC6394594
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