Vitas-M small molecule compound
methyl 3-{[benzyl(2-phenylethyl)carbamothioyl]amino}thiophene-2-carboxylate
Catalog ID
STL131448
SMILES COC(=O)c1sccc1NC(=S)N(Cc1ccccc1)CCc1ccccc1
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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/c1-26-21(25)20-19(13-15-28-20)23-22(27)24(16-18-10-6-3-7-11-18)14-12-17-8-4-2-5-9-17/h2-11,13,15H,12,14,16H2,1H3,(H,23,27)InChIKey
LGMDHHIBXNIMKS-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(C=CS1)NC(=S)N(CCC2=CC=CC=C2)CC3=CC=CC=C3
InChI=1SC22H22N2O2S2c12621(25)2019(13152820)2322(27)24(1618106371118)1412178425917h2111315H121416H21H3(H2327)
methyl3((benzyl(2phenylethyl)carbamothioyl)amino)thiophene2carboxylate
MFCD14726210
ZINC000004878156
ZINC4878156
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