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

Systemtic Name: 5-(1,4-diazepan-1-yl)-N,N-diethyl-2-(phenylsulfonyl)aniline Openeye Name: 2-(benzenesulfonyl)-5-(1,4-diazepan-1-yl)-N,N-diethyl-aniline CAS Name: 2-(benzenesulfonyl)-5-(1,4-diazepan-1-yl)-N,N-diethylaniline IUPAC Name: 2-(benzenesulfonyl)-5-(1,4-diazepan-1-yl)-N,N-diethylaniline Traditional Name: [2-besyl-5-(1,4-diazepan-1-yl)phenyl]-diethyl-amine Formula: C21H29N3O2S MolecularWeight: 387.53886

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=CC(=C1)N2CCCNCC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)C1=C(C=CC(=C1)N2CCCNCC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H29N3O2S/c1-3-23(4-2)20-17-18(24-15-8-13-22-14-16-24)11-12-21(20)27(25,26)19-9-6-5-7-10-19/h5-7,9-12,17,22H,3-4,8,13-16H2,1-2H3