ethyl 2-[(4-methoxyphenyl)carbonylamino]-4,5-dihydrobenzo[g][1]benzothiole-3-carboxylate

Systemtic Name: ethyl 2-[(4-methoxyphenyl)carbonylamino]-4,5-dihydrobenzo[g][1]benzothiole-3-carboxylate Openeye Name: ethyl 2-[(4-methoxybenzoyl)amino]-4,5-dihydrobenzo[g]benzothiophene-3-carboxylate CAS Name: 2-[[(4-methoxyphenyl)-oxomethyl]amino]-4,5-dihydrobenzo[g][1]benzothiole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-methoxybenzoyl)amino]-4,5-dihydrobenzo[g][1]benzothiole-3-carboxylate Traditional Name: 2-(p-anisoylamino)-4,5-dihydrobenzo[g]benzothiophene-3-carboxylic acid ethyl ester Formula: C23H21NO4S MolecularWeight: 407.48214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC3=CC=CC=C32)NC(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCC3=CC=CC=C32)NC(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C23H21NO4S/c1-3-28-23(26)19-18-13-10-14-6-4-5-7-17(14)20(18)29-22(19)24-21(25)15-8-11-16(27-2)12-9-15/h4-9,11-12H,3,10,13H2,1-2H3,(H,24,25)