[4-[4-(azepan-1-ylsulfonyl)phenyl]carbonylpiperazin-1-yl]-phenyl-methanone

Systemtic Name: [4-[4-(azepan-1-ylsulfonyl)phenyl]carbonylpiperazin-1-yl]-phenyl-methanone Openeye Name: [4-[4-(azepan-1-ylsulfonyl)benzoyl]piperazin-1-yl]-phenyl-methanone CAS Name: [4-[[4-(1-azepanylsulfonyl)phenyl]-oxomethyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-[4-(azepan-1-ylsulfonyl)benzoyl]piperazin-1-yl]-phenylmethanone Traditional Name: [4-[4-(azepan-1-ylsulfonyl)benzoyl]piperazino]-phenyl-methanone Formula: C24H29N3O4S MolecularWeight: 455.56976

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H29N3O4S/c28-23(20-8-4-3-5-9-20)25-16-18-26(19-17-25)24(29)21-10-12-22(13-11-21)32(30,31)27-14-6-1-2-7-15-27/h3-5,8-13H,1-2,6-7,14-19H2