2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-N-(2-phenylphenyl)propanamide

Systemtic Name: 2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-N-(2-phenylphenyl)propanamide Openeye Name: 2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-N-(2-phenylphenyl)propanamide CAS Name: 2-[4-(1-azepanylsulfonyl)-1-piperazinyl]-N-(2-phenylphenyl)propanamide IUPAC Name: 2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-N-(2-phenylphenyl)propanamide Traditional Name: 2-[4-(azepan-1-ylsulfonyl)piperazino]-N-(2-phenylphenyl)propionamide Formula: C25H34N4O3S MolecularWeight: 470.62746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C2=CC=CC=C2)N3CCN(CC3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1C2=CC=CC=C2)N3CCN(CC3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C25H34N4O3S/c1-21(25(30)26-24-14-8-7-13-23(24)22-11-5-4-6-12-22)27-17-19-29(20-18-27)33(31,32)28-15-9-2-3-10-16-28/h4-8,11-14,21H,2-3,9-10,15-20H2,1H3,(H,26,30)