3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[(4-pyrrolidin-1-ylphenyl)methyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[(4-pyrrolidin-1-ylphenyl)methyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[(4-pyrrolidin-1-ylphenyl)methyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[[4-(1-pyrrolidinyl)phenyl]methyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[(4-pyrrolidin-1-ylphenyl)methyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(4-pyrrolidinobenzyl)benzamide Formula: C24H30ClN3O3S MolecularWeight: 476.0313

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC3=CC=C(C=C3)N4CCCC4)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC3=CC=C(C=C3)N4CCCC4)Cl

InChI

InChI=1S/C24H30ClN3O3S/c25-22-12-9-20(17-23(22)32(30,31)28-15-3-1-2-4-16-28)24(29)26-18-19-7-10-21(11-8-19)27-13-5-6-14-27/h7-12,17H,1-6,13-16,18H2,(H,26,29)