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

Systemtic Name: N-[6-methyl-2-oxidanylidene-1-[3-(pyrimidin-4-ylamino)propyl]pyridin-3-yl]-1-phenyl-methanesulfonamide Openeye Name: N-[6-methyl-2-oxo-1-[3-(pyrimidin-4-ylamino)propyl]-3-pyridyl]-1-phenyl-methanesulfonamide CAS Name: N-[6-methyl-2-oxo-1-[3-(4-pyrimidinylamino)propyl]-3-pyridinyl]-1-phenylmethanesulfonamide IUPAC Name: N-[6-methyl-2-oxo-1-[3-(pyrimidin-4-ylamino)propyl]pyridin-3-yl]-1-phenylmethanesulfonamide Traditional Name: N-[2-keto-6-methyl-1-[3-(4-pyrimidylamino)propyl]-3-pyridyl]-1-phenyl-methanesulfonamide Formula: C20H23N5O3S MolecularWeight: 413.49332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N5O3S/c1-16-8-9-18(24-29(27,28)14-17-6-3-2-4-7-17)20(26)25(16)13-5-11-22-19-10-12-21-15-23-19/h2-4,6-10,12,15,24H,5,11,13-14H2,1H3,(H,21,22,23)