N-[(3S)-1-[3-(6-azanyl-2-methyl-pyridin-3-yl)-2-oxidanylidene-propyl]-2-oxidanylidene-piperidin-3-yl]-1-phenyl-methanesulfonamide

Systemtic Name: N-[(3S)-1-[3-(6-azanyl-2-methyl-pyridin-3-yl)-2-oxidanylidene-propyl]-2-oxidanylidene-piperidin-3-yl]-1-phenyl-methanesulfonamide Openeye Name: N-[(3S)-1-[3-(6-amino-2-methyl-3-pyridyl)-2-oxo-propyl]-2-oxo-3-piperidyl]-1-phenyl-methanesulfonamide CAS Name: N-[(3S)-1-[3-(6-amino-2-methyl-3-pyridinyl)-2-oxopropyl]-2-oxo-3-piperidinyl]-1-phenylmethanesulfonamide IUPAC Name: N-[(3S)-1-[3-(6-amino-2-methylpyridin-3-yl)-2-oxopropyl]-2-oxopiperidin-3-yl]-1-phenylmethanesulfonamide Traditional Name: N-[(3S)-1-[3-(6-amino-2-methyl-3-pyridyl)-2-keto-propyl]-2-keto-3-piperidyl]-1-phenyl-methanesulfonamide Formula: C21H26N4O4S MolecularWeight: 430.52054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)N)CC(=O)CN2CCCC(C2=O)NS(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=N1)N)CC(=O)CN2CCC[C@@H](C2=O)NS(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O4S/c1-15-17(9-10-20(22)23-15)12-18(26)13-25-11-5-8-19(21(25)27)24-30(28,29)14-16-6-3-2-4-7-16/h2-4,6-7,9-10,19,24H,5,8,11-14H2,1H3,(H2,22,23)/t19-/m0/s1