3-(azepan-1-ylsulfonyl)-N-[3-(imidazol-1-ylmethyl)phenyl]-4-methoxy-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[3-(imidazol-1-ylmethyl)phenyl]-4-methoxy-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[3-(imidazol-1-ylmethyl)phenyl]-4-methoxy-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[3-(1-imidazolylmethyl)phenyl]-4-methoxybenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[3-(imidazol-1-ylmethyl)phenyl]-4-methoxybenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[3-(imidazol-1-ylmethyl)phenyl]-4-methoxy-benzamide Formula: C24H28N4O4S MolecularWeight: 468.56852

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)CN3C=CN=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)CN3C=CN=C3)S(=O)(=O)N4CCCCCC4

InChI

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