Vitas-M small molecule compound
methyl 2-{[(1-benzylpiperidin-4-yl)carbamothioyl]amino}-4-ethyl-5-methylthiophene-3-carboxylate
Catalog ID
STK456159
SMILES COC(=O)c1c(NC(=S)NC2CCN(CC2)Cc2ccccc2)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 C22H29N3O2S2 MW 431.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N3O2S2/c1-4-18-15(2)29-20(19(18)21(26)27-3)24-22(28)23-17-10-12-25(13-11-17)14-16-8-6-5-7-9-16/h5-9,17H,4,10-14H2,1-3H3,(H2,23,24,28)InChIKey
GUCGBCDYLMXYAX-UHFFFAOYSA-NSynonyms
CCC1=C(SC(=C1C(=O)OC)NC(=S)NC2CCN(CC2)CC3=CC=CC=C3)C
InChI=1SC22H29N3O2S2c141815(2)2920(19(18)21(26)273)2422(28)2317101225(131117)14168657916h5917H41014H213H3(H2232428)
methyl2(((1benzylpiperidin4yl)carbamothioyl)amino)4ethyl5methylthiophene3carboxylate
METHYL2((1BENZYLPIPERIDIN4YL)CARBAMOTHIOYLAMINO)4ETHYL5METHYLTHIOPHENE3CARBOXYLATE
METHYL4ETHYL5METHYL2((((1BENZYL(4PIPERIDYL))AMINO)THIOXOMETHYL)AMINO)THIOPHENE3CARBOXYLATE
MFCD05065183
ZINC000016361131
ZINC16361131
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