N-ethyl-5-(4-methyl-1,4-diazepan-1-yl)-2-(phenylsulfonyl)aniline

Systemtic Name: N-ethyl-5-(4-methyl-1,4-diazepan-1-yl)-2-(phenylsulfonyl)aniline Openeye Name: 2-(benzenesulfonyl)-N-ethyl-5-(4-methyl-1,4-diazepan-1-yl)aniline CAS Name: 2-(benzenesulfonyl)-N-ethyl-5-(4-methyl-1,4-diazepan-1-yl)aniline IUPAC Name: 2-(benzenesulfonyl)-N-ethyl-5-(4-methyl-1,4-diazepan-1-yl)aniline Traditional Name: [2-besyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]-ethyl-amine Formula: C20H27N3O2S MolecularWeight: 373.51228

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=CC(=C1)N2CCCN(CC2)C)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCNC1=C(C=CC(=C1)N2CCCN(CC2)C)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H27N3O2S/c1-3-21-19-16-17(23-13-7-12-22(2)14-15-23)10-11-20(19)26(24,25)18-8-5-4-6-9-18/h4-6,8-11,16,21H,3,7,12-15H2,1-2H3