N-[6-methyl-2-oxidanylidene-1-[3-(pyridin-4-ylamino)propyl]pyridin-3-yl]-1-phenyl-methanesulfonamide

Systemtic Name: N-[6-methyl-2-oxidanylidene-1-[3-(pyridin-4-ylamino)propyl]pyridin-3-yl]-1-phenyl-methanesulfonamide Openeye Name: N-[6-methyl-2-oxo-1-[3-(4-pyridylamino)propyl]-3-pyridyl]-1-phenyl-methanesulfonamide CAS Name: N-[6-methyl-2-oxo-1-[3-(pyridin-4-ylamino)propyl]-3-pyridinyl]-1-phenylmethanesulfonamide IUPAC Name: N-[6-methyl-2-oxo-1-[3-(pyridin-4-ylamino)propyl]pyridin-3-yl]-1-phenylmethanesulfonamide Traditional Name: N-[2-keto-6-methyl-1-[3-(4-pyridylamino)propyl]-3-pyridyl]-1-phenyl-methanesulfonamide Formula: C21H24N4O3S MolecularWeight: 412.50526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C(=O)N1CCCNC2=CC=NC=C2)NS(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C(=O)N1CCCNC2=CC=NC=C2)NS(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H24N4O3S/c1-17-8-9-20(24-29(27,28)16-18-6-3-2-4-7-18)21(26)25(17)15-5-12-23-19-10-13-22-14-11-19/h2-4,6-11,13-14,24H,5,12,15-16H2,1H3,(H,22,23)