Vitas-M small molecule compound

N-(2-methylbenzyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Catalog ID
STL028217
SMILES O=C(c1cc2c(s1)CCCC2)NCc1ccccc1C

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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 C17H19NOS MW 285.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19NOS/c1-12-6-2-3-8-14(12)11-18-17(19)16-10-13-7-4-5-9-15(13)20-16/h2-3,6,8,10H,4-5,7,9,11H2,1H3,(H,18,19)
InChIKey
MLHBNEQSMNNZEF-UHFFFAOYSA-N
Synonyms
1001826-05-6
1001826056
CC1=CC=CC=C1CNC(=O)C2=CC3=C(S2)CCCC3
InChI=1SC17H19NOSc112623814(12)111817(19)161013745915(13)2016h236810H457911H21H3(H1819)
MFCD10778583
N((2methylphenyl)methyl)4567tetrahydro1benzothiophene2carboxamide
N(2methylbenzyl)4567tetrahydro1benzothiophene2carboxamide
ZINC000005089786
ZINC05089786
ZINC5089786

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Available files

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