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

Systemtic Name: [3-(azepan-1-ylsulfonyl)-4-chloranyl-phenyl]-[4-(phenylmethyl)piperidin-1-yl]methanone Openeye Name: [3-(azepan-1-ylsulfonyl)-4-chloro-phenyl]-(4-benzyl-1-piperidyl)methanone CAS Name: [3-(1-azepanylsulfonyl)-4-chlorophenyl]-[4-(phenylmethyl)-1-piperidinyl]methanone IUPAC Name: [3-(azepan-1-ylsulfonyl)-4-chlorophenyl]-(4-benzylpiperidin-1-yl)methanone Traditional Name: [3-(azepan-1-ylsulfonyl)-4-chloro-phenyl]-(4-benzylpiperidino)methanone Formula: C25H31ClN2O3S MolecularWeight: 475.04324

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCC(CC3)CC4=CC=CC=C4)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCC(CC3)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C25H31ClN2O3S/c26-23-11-10-22(19-24(23)32(30,31)28-14-6-1-2-7-15-28)25(29)27-16-12-21(13-17-27)18-20-8-4-3-5-9-20/h3-5,8-11,19,21H,1-2,6-7,12-18H2