(E)-3-(6-methyl-4-oxidanylidene-quinazolin-3-yl)-N-(4-pyridin-3-ylbutyl)prop-2-enamide

Systemtic Name: (E)-3-(6-methyl-4-oxidanylidene-quinazolin-3-yl)-N-(4-pyridin-3-ylbutyl)prop-2-enamide Openeye Name: (E)-3-(6-methyl-4-oxo-quinazolin-3-yl)-N-[4-(3-pyridyl)butyl]prop-2-enamide CAS Name: (E)-3-(6-methyl-4-oxo-3-quinazolinyl)-N-[4-(3-pyridinyl)butyl]-2-propenamide IUPAC Name: (E)-3-(6-methyl-4-oxoquinazolin-3-yl)-N-(4-pyridin-3-ylbutyl)prop-2-enamide Traditional Name: (E)-3-(4-keto-6-methyl-quinazolin-3-yl)-N-[4-(3-pyridyl)butyl]acrylamide Formula: C21H22N4O2 MolecularWeight: 362.42498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=CN(C2=O)C=CC(=O)NCCCCC3=CN=CC=C3

Isomeric SMILES

CC1=CC2=C(C=C1)N=CN(C2=O)/C=C/C(=O)NCCCCC3=CN=CC=C3

InChI

InChI=1S/C21H22N4O2/c1-16-7-8-19-18(13-16)21(27)25(15-24-19)12-9-20(26)23-11-3-2-5-17-6-4-10-22-14-17/h4,6-10,12-15H,2-3,5,11H2,1H3,(H,23,26)/b12-9+