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

Systemtic Name: ethyl 2-[(2-bromophenyl)carbonylamino]-4,5-dihydrobenzo[g][1]benzothiole-3-carboxylate Openeye Name: ethyl 2-[(2-bromobenzoyl)amino]-4,5-dihydrobenzo[g]benzothiophene-3-carboxylate CAS Name: 2-[[(2-bromophenyl)-oxomethyl]amino]-4,5-dihydrobenzo[g][1]benzothiole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-bromobenzoyl)amino]-4,5-dihydrobenzo[g][1]benzothiole-3-carboxylate Traditional Name: 2-[(2-bromobenzoyl)amino]-4,5-dihydrobenzo[g]benzothiophene-3-carboxylic acid ethyl ester Formula: C22H18BrNO3S MolecularWeight: 456.35222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC3=CC=CC=C32)NC(=O)C4=CC=CC=C4Br

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCC3=CC=CC=C32)NC(=O)C4=CC=CC=C4Br

InChI

InChI=1S/C22H18BrNO3S/c1-2-27-22(26)18-16-12-11-13-7-3-4-8-14(13)19(16)28-21(18)24-20(25)15-9-5-6-10-17(15)23/h3-10H,2,11-12H2,1H3,(H,24,25)