N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-6-imidazol-1-yl-pyridine-3-carboxamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-6-imidazol-1-yl-pyridine-3-carboxamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-6-imidazol-1-yl-pyridine-3-carboxamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-6-(1-imidazolyl)-3-pyridinecarboxamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-6-imidazol-1-ylpyridine-3-carboxamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-6-imidazol-1-yl-nicotinamide Formula: C22H25N5O3S MolecularWeight: 439.5306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CN=C(C=C2)N3C=CN=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CN=C(C=C2)N3C=CN=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C22H25N5O3S/c1-17-6-8-19(14-20(17)31(29,30)27-11-4-2-3-5-12-27)25-22(28)18-7-9-21(24-15-18)26-13-10-23-16-26/h6-10,13-16H,2-5,11-12H2,1H3,(H,25,28)