2-[2-(7-azanyl-3,4,5,6-tetrahydro-2H-azepin-2-yl)ethyl]benzenesulfonamide

Systemtic Name: 2-[2-(7-azanyl-3,4,5,6-tetrahydro-2H-azepin-2-yl)ethyl]benzenesulfonamide Openeye Name: 2-[2-(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)ethyl]benzenesulfonamide CAS Name: 2-[2-(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)ethyl]benzenesulfonamide IUPAC Name: 2-[2-(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)ethyl]benzenesulfonamide Traditional Name: 2-[2-(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)ethyl]benzenesulfonamide Formula: C14H21N3O2S MolecularWeight: 295.40044

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NC(C1)CCC2=CC=CC=C2S(=O)(=O)N)N

Isomeric SMILES

C1CCC(=NC(C1)CCC2=CC=CC=C2S(=O)(=O)N)N

InChI

InChI=1S/C14H21N3O2S/c15-14-8-4-2-6-12(17-14)10-9-11-5-1-3-7-13(11)20(16,18)19/h1,3,5,7,12H,2,4,6,8-10H2,(H2,15,17)(H2,16,18,19)