3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[(2-imidazol-1-ylphenyl)methyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[(2-imidazol-1-ylphenyl)methyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[(2-imidazol-1-ylphenyl)methyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[[2-(1-imidazolyl)phenyl]methyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[(2-imidazol-1-ylphenyl)methyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-imidazol-1-ylbenzyl)benzamide Formula: C23H25ClN4O3S MolecularWeight: 472.9876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC3=CC=CC=C3N4C=CN=C4)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC3=CC=CC=C3N4C=CN=C4)Cl

InChI

InChI=1S/C23H25ClN4O3S/c24-20-10-9-18(15-22(20)32(30,31)28-12-5-1-2-6-13-28)23(29)26-16-19-7-3-4-8-21(19)27-14-11-25-17-27/h3-4,7-11,14-15,17H,1-2,5-6,12-13,16H2,(H,26,29)