azepan-1-yl-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: azepan-1-yl-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: azepan-1-yl-[4-(2-naphthylsulfonyl)piperazin-1-yl]methanone CAS Name: 1-azepanyl-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]methanone IUPAC Name: azepan-1-yl-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: azepan-1-yl-[4-(2-naphthylsulfonyl)piperazino]methanone Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CCCN(CC1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H27N3O3S/c25-21(22-11-5-1-2-6-12-22)23-13-15-24(16-14-23)28(26,27)20-10-9-18-7-3-4-8-19(18)17-20/h3-4,7-10,17H,1-2,5-6,11-16H2