Vitas-M small molecule compound

ethyl 2-{[(2-methylphenyl)carbonyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate

Catalog ID
STK015523
SMILES CCOC(=O)c1c(NC(=O)c2ccccc2C)sc2c1CCCCC2

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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 C20H23NO3S MW 357.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23NO3S/c1-3-24-20(23)17-15-11-5-4-6-12-16(15)25-19(17)21-18(22)14-10-8-7-9-13(14)2/h7-10H,3-6,11-12H2,1-2H3,(H,21,22)
InChIKey
GRCQMJKFNAQGPK-UHFFFAOYSA-N
Synonyms
312949-75-0
312949750
CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C3=CC=CC=C3C
CCOC(=O)c1c(NC(=O)c2ccccc2C)sc2c1CCCCC2
ethyl2(((2methylphenyl)carbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ethyl2((2methylbenzoyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
InChI=1SC20H23NO3Sc132420(23)1715115461216(15)2519(17)2118(22)141087913(14)2h710H361112H212H3(H2122)
MFCD01990109
STK015523
ZINC000001213714
ZINC01213714
ZINC1213714

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Available files

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