Vitas-M small molecule compound

methyl 2-[(phenylcarbamoyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate

Catalog ID
STK437475
SMILES COC(=O)c1c(NC(=O)Nc2ccccc2)sc2c1CCCCCC2

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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 C19H22N2O3S MW 358.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N2O3S/c1-24-18(22)16-14-11-7-2-3-8-12-15(14)25-17(16)21-19(23)20-13-9-5-4-6-10-13/h4-6,9-10H,2-3,7-8,11-12H2,1H3,(H2,20,21,23)
InChIKey
FLGBAPKSXVYEOA-UHFFFAOYSA-N
Synonyms

COC(=O)C1=C(SC2=C1CCCCCC2)NC(=O)NC3=CC=CC=C3
InChI=1SC19H22N2O3Sc12418(22)16141172381215(14)2517(16)2119(23)201395461013h46910H23781112H21H3(H2202123)
methyl2((phenylcarbamoyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
methyl2(phenylcarbamoylamino)456789hexahydrocycloocta(b)thiophene3carboxylate
MFCD01342304
ZINC000000694933
ZINC00694933
ZINC694933

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Available files

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