3-(azepan-1-ylsulfonyl)-N-[1-(4-imidazol-1-ylphenyl)ethyl]-4-methoxy-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[1-(4-imidazol-1-ylphenyl)ethyl]-4-methoxy-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[1-(4-imidazol-1-ylphenyl)ethyl]-4-methoxy-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[1-[4-(1-imidazolyl)phenyl]ethyl]-4-methoxybenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[1-(4-imidazol-1-ylphenyl)ethyl]-4-methoxybenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[1-(4-imidazol-1-ylphenyl)ethyl]-4-methoxy-benzamide Formula: C25H30N4O4S MolecularWeight: 482.5951

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=CN=C2)NC(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC(C1=CC=C(C=C1)N2C=CN=C2)NC(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C25H30N4O4S/c1-19(20-7-10-22(11-8-20)28-16-13-26-18-28)27-25(30)21-9-12-23(33-2)24(17-21)34(31,32)29-14-5-3-4-6-15-29/h7-13,16-19H,3-6,14-15H2,1-2H3,(H,27,30)