[3-(azepan-1-ylsulfonyl)-4-chloranyl-phenyl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [3-(azepan-1-ylsulfonyl)-4-chloranyl-phenyl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [3-(azepan-1-ylsulfonyl)-4-chloro-phenyl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [3-(1-azepanylsulfonyl)-4-chlorophenyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [3-(azepan-1-ylsulfonyl)-4-chlorophenyl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [3-(azepan-1-ylsulfonyl)-4-chloro-phenyl]-(4-phenylpiperazino)methanone Formula: C23H28ClN3O3S MolecularWeight: 462.00472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28ClN3O3S/c24-21-11-10-19(18-22(21)31(29,30)27-12-6-1-2-7-13-27)23(28)26-16-14-25(15-17-26)20-8-4-3-5-9-20/h3-5,8-11,18H,1-2,6-7,12-17H2