5-(azepan-1-ylsulfonyl)-N-[(4-imidazol-1-ylphenyl)methyl]-2-methoxy-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-[(4-imidazol-1-ylphenyl)methyl]-2-methoxy-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-[(4-imidazol-1-ylphenyl)methyl]-2-methoxy-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-[[4-(1-imidazolyl)phenyl]methyl]-2-methoxybenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-[(4-imidazol-1-ylphenyl)methyl]-2-methoxybenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-(4-imidazol-1-ylbenzyl)-2-methoxy-benzamide Formula: C24H28N4O4S MolecularWeight: 468.56852

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NCC3=CC=C(C=C3)N4C=CN=C4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NCC3=CC=C(C=C3)N4C=CN=C4

InChI

InChI=1S/C24H28N4O4S/c1-32-23-11-10-21(33(30,31)28-13-4-2-3-5-14-28)16-22(23)24(29)26-17-19-6-8-20(9-7-19)27-15-12-25-18-27/h6-12,15-16,18H,2-5,13-14,17H2,1H3,(H,26,29)