Vitas-M small molecule compound
ethyl 2-{[(diphenylacetyl)carbamothioyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK053415
SMILES CCOC(=O)c1c(NC(=S)NC(=O)C(c2ccccc2)c2ccccc2)sc2c1CCCC2
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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 C26H26N2O3S2 MW 478.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O3S2/c1-2-31-25(30)22-19-15-9-10-16-20(19)33-24(22)28-26(32)27-23(29)21(17-11-5-3-6-12-17)18-13-7-4-8-14-18/h3-8,11-14,21H,2,9-10,15-16H2,1H3,(H2,27,28,29,32)InChIKey
VABNDTGVMPQOBH-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=S)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4
CCOC(=O)c1c(NC(=S)NC(=O)C(c2ccccc2)c2ccccc2)sc2c1CCCC2
ethyl2(((diphenylacetyl)carbamothioyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((22diphenylacetyl)carbamothioylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC26H26N2O3S2c123125(30)2219159101620(19)3324(22)2826(32)2723(29)21(17115361217)18137481418h38111421H29101516H21H3(H227282932)
MFCD02631393
STK053415
ZINC000002052195
ZINC02052195
ZINC2052195
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