Vitas-M small molecule compound

methyl 2-[(biphenyl-4-ylcarbonyl)amino]-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK315477
SMILES CCC1CCc2c(C1)sc(c2C(=O)OC)NC(=O)c1ccc(cc1)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 C25H25NO3S MW 419.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25NO3S/c1-3-16-9-14-20-21(15-16)30-24(22(20)25(28)29-2)26-23(27)19-12-10-18(11-13-19)17-7-5-4-6-8-17/h4-8,10-13,16H,3,9,14-15H2,1-2H3,(H,26,27)
InChIKey
WNZVQIZAAVSFPE-UHFFFAOYSA-N
Synonyms
354543-47-8
354543478
CCC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=CC=C(C=C3)C4=CC=CC=C4
InChI=1SC25H25NO3Sc13169142021(1516)3024(22(20)25(28)292)2623(27)19121018(111319)177546817h48101316H391415H212H3(H2627)
methyl2((biphenyl4ylcarbonyl)amino)6ethyl4567tetrahydro1benzothiophene3carboxylate
methyl6ethyl2((4phenylbenzoyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD01339608
ZINC000002093082
ZINC000002093084

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.