Vitas-M small molecule compound
methyl 2-{[(4-methoxybenzyl)carbamothioyl]amino}-5-phenylthiophene-3-carboxylate
Catalog ID
STK438670
SMILES COC(=O)c1cc(sc1NC(=S)NCc1ccc(cc1)OC)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 C21H20N2O3S2 MW 412.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O3S2/c1-25-16-10-8-14(9-11-16)13-22-21(27)23-19-17(20(24)26-2)12-18(28-19)15-6-4-3-5-7-15/h3-12H,13H2,1-2H3,(H2,22,23,27)InChIKey
CLLWGAYUJLGZOI-UHFFFAOYSA-NSynonyms
COC1=CC=C(C=C1)CNC(=S)NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)OC
InChI=1SC21H20N2O3S2c1251610814(91116)132221(27)231917(20(24)262)1218(2819)156435715h312H13H212H3(H2222327)
METHYL2(((((4METHOXYPHENYL)METHYL)AMINO)THIOXOMETHYL)AMINO)5PHENYLTHIOPHENE3CARBOXYLATE
methyl2(((4methoxybenzyl)carbamothioyl)amino)5phenylthiophene3carboxylate
METHYL2((4METHOXYPHENYL)METHYLCARBAMOTHIOYLAMINO)5PHENYLTHIOPHENE3CARBOXYLATE
MFCD03945638
ZINC000006145754
ZINC06145754
ZINC6145754
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