Vitas-M small molecule compound

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

Catalog ID
STK448785
SMILES CCCOC(=O)c1c(NC(=O)c2ccc(cc2)c2ccccc2)sc2c1CCC(C2)C

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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 C26H27NO3S MW 433.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27NO3S/c1-3-15-30-26(29)23-21-14-9-17(2)16-22(21)31-25(23)27-24(28)20-12-10-19(11-13-20)18-7-5-4-6-8-18/h4-8,10-13,17H,3,9,14-16H2,1-2H3,(H,27,28)
InChIKey
BLYJFJOYWDBESV-UHFFFAOYSA-N
Synonyms

CCCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)C3=CC=C(C=C3)C4=CC=CC=C4
InChI=1SC26H27NO3Sc13153026(29)232114917(2)1622(21)3125(23)2724(28)20121019(111320)187546818h48101317H391416H212H3(H2728)
MFCD01920102
propyl2((biphenyl4ylcarbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
propyl6methyl2((4phenylbenzoyl)amino)4567tetrahydro1benzothiophene3carboxylate
ZINC000008432151
ZINC000008432153

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Available files

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