N-[(4-bromophenyl)methyl]-N-methyl-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide

Systemtic Name: N-[(4-bromophenyl)methyl]-N-methyl-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide Openeye Name: N-[(4-bromophenyl)methyl]-N-methyl-4,5-dihydrobenzo[g]benzothiophene-2-carboxamide CAS Name: N-[(4-bromophenyl)methyl]-N-methyl-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide IUPAC Name: N-[(4-bromophenyl)methyl]-N-methyl-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide Traditional Name: N-(4-bromobenzyl)-N-methyl-4,5-dihydrobenzo[g]benzothiophene-2-carboxamide Formula: C21H18BrNOS MolecularWeight: 412.34272

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)Br)C(=O)C2=CC3=C(S2)C4=CC=CC=C4CC3

Isomeric SMILES

CN(CC1=CC=C(C=C1)Br)C(=O)C2=CC3=C(S2)C4=CC=CC=C4CC3

InChI

InChI=1S/C21H18BrNOS/c1-23(13-14-6-10-17(22)11-7-14)21(24)19-12-16-9-8-15-4-2-3-5-18(15)20(16)25-19/h2-7,10-12H,8-9,13H2,1H3