methyl 7-methoxy-2-[2-(2-methylphenyl)ethanoylamino]-4,5-dihydrobenzo[e][1]benzothiole-1-carboxylate

Systemtic Name: methyl 7-methoxy-2-[2-(2-methylphenyl)ethanoylamino]-4,5-dihydrobenzo[e][1]benzothiole-1-carboxylate Openeye Name: methyl 7-methoxy-2-[[2-(o-tolyl)acetyl]amino]-4,5-dihydrobenzo[e]benzothiophene-1-carboxylate CAS Name: 7-methoxy-2-[[2-(2-methylphenyl)-1-oxoethyl]amino]-4,5-dihydrobenzo[e][1]benzothiole-1-carboxylic acid methyl ester IUPAC Name: methyl 7-methoxy-2-[[2-(2-methylphenyl)acetyl]amino]-4,5-dihydrobenzo[e][1]benzothiole-1-carboxylate Traditional Name: 7-methoxy-2-[[2-(o-tolyl)acetyl]amino]-4,5-dihydrobenzo[e]benzothiophene-1-carboxylic acid methyl ester Formula: C24H23NO4S MolecularWeight: 421.50872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)NC2=C(C3=C(S2)CCC4=C3C=CC(=C4)OC)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1CC(=O)NC2=C(C3=C(S2)CCC4=C3C=CC(=C4)OC)C(=O)OC

InChI

InChI=1S/C24H23NO4S/c1-14-6-4-5-7-15(14)13-20(26)25-23-22(24(27)29-3)21-18-10-9-17(28-2)12-16(18)8-11-19(21)30-23/h4-7,9-10,12H,8,11,13H2,1-3H3,(H,25,26)