5-(azepan-1-ylsulfonyl)-N-[(2-imidazol-1-ylphenyl)methyl]-2-methyl-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-[(2-imidazol-1-ylphenyl)methyl]-2-methyl-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-[(2-imidazol-1-ylphenyl)methyl]-2-methyl-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-[[2-(1-imidazolyl)phenyl]methyl]-2-methylbenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-[(2-imidazol-1-ylphenyl)methyl]-2-methylbenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-(2-imidazol-1-ylbenzyl)-2-methyl-benzamide Formula: C24H28N4O3S MolecularWeight: 452.56912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NCC3=CC=CC=C3N4C=CN=C4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NCC3=CC=CC=C3N4C=CN=C4

InChI

InChI=1S/C24H28N4O3S/c1-19-10-11-21(32(30,31)28-13-6-2-3-7-14-28)16-22(19)24(29)26-17-20-8-4-5-9-23(20)27-15-12-25-18-27/h4-5,8-12,15-16,18H,2-3,6-7,13-14,17H2,1H3,(H,26,29)