[5-(azepan-1-ylsulfonyl)-2-chloranyl-phenyl]-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: [5-(azepan-1-ylsulfonyl)-2-chloranyl-phenyl]-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: [5-(azepan-1-ylsulfonyl)-2-chloro-phenyl]-(4-benzylpiperazin-1-yl)methanone CAS Name: [5-(1-azepanylsulfonyl)-2-chlorophenyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: [5-(azepan-1-ylsulfonyl)-2-chlorophenyl]-(4-benzylpiperazin-1-yl)methanone Traditional Name: [5-(azepan-1-ylsulfonyl)-2-chloro-phenyl]-(4-benzylpiperazino)methanone Formula: C24H30ClN3O3S MolecularWeight: 476.0313

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C24H30ClN3O3S/c25-23-11-10-21(32(30,31)28-12-6-1-2-7-13-28)18-22(23)24(29)27-16-14-26(15-17-27)19-20-8-4-3-5-9-20/h3-5,8-11,18H,1-2,6-7,12-17,19H2