N-[(4-azanylcyclohexyl)methyl]-2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxidanylidene-pyridin-1-yl]ethanamide

Systemtic Name: N-[(4-azanylcyclohexyl)methyl]-2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxidanylidene-pyridin-1-yl]ethanamide Openeye Name: N-[(4-aminocyclohexyl)methyl]-2-[6-methyl-2-oxo-3-(p-tolylsulfonylamino)-1-pyridyl]acetamide CAS Name: N-[(4-aminocyclohexyl)methyl]-2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]acetamide IUPAC Name: N-[(4-aminocyclohexyl)methyl]-2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxopyridin-1-yl]acetamide Traditional Name: N-[(4-aminocyclohexyl)methyl]-2-[2-keto-6-methyl-3-(tosylamino)-1-pyridyl]acetamide Formula: C22H30N4O4S MolecularWeight: 446.563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(N(C2=O)CC(=O)NCC3CCC(CC3)N)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(N(C2=O)CC(=O)NCC3CCC(CC3)N)C

InChI

InChI=1S/C22H30N4O4S/c1-15-3-10-19(11-4-15)31(29,30)25-20-12-5-16(2)26(22(20)28)14-21(27)24-13-17-6-8-18(23)9-7-17/h3-5,10-12,17-18,25H,6-9,13-14,23H2,1-2H3,(H,24,27)