Vitas-M small molecule compound
ethyl 2-{[(4-methylbenzyl)carbamothioyl]amino}-5-phenylthiophene-3-carboxylate
Catalog ID
STK438635
SMILES CCOC(=O)c1cc(sc1NC(=S)NCc1ccc(cc1)C)c1ccccc1
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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 C22H22N2O2S2 MW 410.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O2S2/c1-3-26-21(25)18-13-19(17-7-5-4-6-8-17)28-20(18)24-22(27)23-14-16-11-9-15(2)10-12-16/h4-13H,3,14H2,1-2H3,(H2,23,24,27)InChIKey
DQEIZYSCEMQXKB-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NCC3=CC=C(C=C3)C
ETHYL2(((((4METHYLPHENYL)METHYL)AMINO)THIOXOMETHYL)AMINO)5PHENYLTHIOPHENE3CARBOXYLATE
ethyl2(((4methylbenzyl)carbamothioyl)amino)5phenylthiophene3carboxylate
ETHYL2((4METHYLPHENYL)METHYLCARBAMOTHIOYLAMINO)5PHENYLTHIOPHENE3CARBOXYLATE
InChI=1SC22H22N2O2S2c132621(25)181319(177546817)2820(18)2422(27)23141611915(2)101216h413H314H212H3(H2232427)
MFCD03945382
ZINC000005980028
ZINC05980028
ZINC5980028
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