1-(azepan-1-yl)-2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)propan-1-one

Systemtic Name: 1-(azepan-1-yl)-2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)propan-1-one Openeye Name: 1-(azepan-1-yl)-2-[4-(2-naphthylsulfonyl)piperazin-1-yl]propan-1-one CAS Name: 1-(1-azepanyl)-2-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(azepan-1-yl)-2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)propan-1-one Traditional Name: 1-(azepan-1-yl)-2-[4-(2-naphthylsulfonyl)piperazino]propan-1-one Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C(=O)N1CCCCCC1)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C23H31N3O3S/c1-19(23(27)25-12-6-2-3-7-13-25)24-14-16-26(17-15-24)30(28,29)22-11-10-20-8-4-5-9-21(20)18-22/h4-5,8-11,18-19H,2-3,6-7,12-17H2,1H3