Vitas-M small molecule compound

methyl 2-(acetylamino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK454168
SMILES COC(=O)c1c(NC(=O)C)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 C13H17NO3S MW 267.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17NO3S/c1-7-4-5-9-10(6-7)18-12(14-8(2)15)11(9)13(16)17-3/h7H,4-6H2,1-3H3,(H,14,15)
InChIKey
NZKHQXOQTASZDE-UHFFFAOYSA-N
Synonyms
354997-06-1
354997061
CC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C
InChI=1SC13H17NO3Sc1745910(67)1812(148(2)15)11(9)13(16)173h7H46H213H3(H1415)
methyl2(acetylamino)6methyl4567tetrahydro1benzothiophene3carboxylate
methyl2acetamido6methyl4567tetrahydro1benzothiophene3carboxylate
MFCD01346048
ZINC000000118400
ZINC000000118403

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Available files

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