N-(3-azanylpropyl)-3-[4,5-dimethyl-6-oxidanylidene-1-(phenylmethyl)pyrimidin-2-yl]-2-methyl-propanamide

Systemtic Name: N-(3-azanylpropyl)-3-[4,5-dimethyl-6-oxidanylidene-1-(phenylmethyl)pyrimidin-2-yl]-2-methyl-propanamide Openeye Name: N-(3-aminopropyl)-3-(1-benzyl-4,5-dimethyl-6-oxo-pyrimidin-2-yl)-2-methyl-propanamide CAS Name: N-(3-aminopropyl)-3-[4,5-dimethyl-6-oxo-1-(phenylmethyl)-2-pyrimidinyl]-2-methylpropanamide IUPAC Name: N-(3-aminopropyl)-3-(1-benzyl-4,5-dimethyl-6-oxopyrimidin-2-yl)-2-methylpropanamide Traditional Name: N-(3-aminopropyl)-3-(1-benzyl-6-keto-4,5-dimethyl-pyrimidin-2-yl)-2-methyl-propionamide Formula: C20H28N4O2 MolecularWeight: 356.46192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N(C1=O)CC2=CC=CC=C2)CC(C)C(=O)NCCCN)C

Isomeric SMILES

CC1=C(N=C(N(C1=O)CC2=CC=CC=C2)CC(C)C(=O)NCCCN)C

InChI

InChI=1S/C20H28N4O2/c1-14(19(25)22-11-7-10-21)12-18-23-16(3)15(2)20(26)24(18)13-17-8-5-4-6-9-17/h4-6,8-9,14H,7,10-13,21H2,1-3H3,(H,22,25)