Vitas-M small molecule compound

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

Catalog ID
STK077633
SMILES CCOC(=O)c1c(NC(=O)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 C19H21NO3S MW 343.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21NO3S/c1-3-23-19(22)16-14-10-9-12(2)11-15(14)24-18(16)20-17(21)13-7-5-4-6-8-13/h4-8,12H,3,9-11H2,1-2H3,(H,20,21)
InChIKey
OVEZUDMTMBOSLP-UHFFFAOYSA-N
Synonyms
76981-82-3
76981823
CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)C3=CC=CC=C3
CCOC(=O)c1c(NC(=O)c2ccccc2)sc2c1CCC(C2)C
ethyl2benzamido6methyl4567tetrahydro1benzothiophene3carboxylate
ethyl2benzamido6methyl4567tetrahydrobenzo(b)thiophene3carboxylate
ethyl6methyl2((phenylcarbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC19H21NO3Sc132319(22)161410912(2)1115(14)2418(16)2017(21)137546813h4812H3911H212H3(H2021)
MFCD00688081
STK077633
ZINC000000127464
ZINC000000127467

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Available files

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