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

Systemtic Name: 5-(1,4-diazepan-1-yl)-2-(phenylsulfonyl)aniline Openeye Name: 2-(benzenesulfonyl)-5-(1,4-diazepan-1-yl)aniline CAS Name: 2-(benzenesulfonyl)-5-(1,4-diazepan-1-yl)aniline IUPAC Name: 2-(benzenesulfonyl)-5-(1,4-diazepan-1-yl)aniline Traditional Name: [2-besyl-5-(1,4-diazepan-1-yl)phenyl]amine Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C2=CC(=C(C=C2)S(=O)(=O)C3=CC=CC=C3)N

Isomeric SMILES

C1CNCCN(C1)C2=CC(=C(C=C2)S(=O)(=O)C3=CC=CC=C3)N

InChI

InChI=1S/C17H21N3O2S/c18-16-13-14(20-11-4-9-19-10-12-20)7-8-17(16)23(21,22)15-5-2-1-3-6-15/h1-3,5-8,13,19H,4,9-12,18H2