methyl 2-(cyclobutylcarbonylamino)-4,5-dihydrobenzo[e][1]benzothiole-1-carboxylate

Systemtic Name: methyl 2-(cyclobutylcarbonylamino)-4,5-dihydrobenzo[e][1]benzothiole-1-carboxylate Openeye Name: methyl 2-(cyclobutanecarbonylamino)-4,5-dihydrobenzo[e]benzothiophene-1-carboxylate CAS Name: 2-[[cyclobutyl(oxo)methyl]amino]-4,5-dihydrobenzo[e][1]benzothiole-1-carboxylic acid methyl ester IUPAC Name: methyl 2-(cyclobutanecarbonylamino)-4,5-dihydrobenzo[e][1]benzothiole-1-carboxylate Traditional Name: 2-(cyclobutanecarbonylamino)-4,5-dihydrobenzo[e]benzothiophene-1-carboxylic acid methyl ester Formula: C19H19NO3S MolecularWeight: 341.42406

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1C3=CC=CC=C3CC2)NC(=O)C4CCC4

Isomeric SMILES

COC(=O)C1=C(SC2=C1C3=CC=CC=C3CC2)NC(=O)C4CCC4

InChI

InChI=1S/C19H19NO3S/c1-23-19(22)16-15-13-8-3-2-5-11(13)9-10-14(15)24-18(16)20-17(21)12-6-4-7-12/h2-3,5,8,12H,4,6-7,9-10H2,1H3,(H,20,21)