2-oxidanyl-11-oxidanylidene-N-(4-pyridin-3-ylbutyl)pyrido[2,1-b]quinazoline-8-carboxamide

Systemtic Name: 2-oxidanyl-11-oxidanylidene-N-(4-pyridin-3-ylbutyl)pyrido[2,1-b]quinazoline-8-carboxamide Openeye Name: 2-hydroxy-11-oxo-N-[4-(3-pyridyl)butyl]pyrido[2,1-b]quinazoline-8-carboxamide CAS Name: 2-hydroxy-11-oxo-N-[4-(3-pyridinyl)butyl]-8-pyrido[2,1-b]quinazolinecarboxamide IUPAC Name: 2-hydroxy-11-oxo-N-(4-pyridin-3-ylbutyl)pyrido[2,1-b]quinazoline-8-carboxamide Traditional Name: 2-hydroxy-11-keto-N-[4-(3-pyridyl)butyl]pyrido[2,1-b]quinazoline-8-carboxamide Formula: C22H20N4O3 MolecularWeight: 388.4192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CCCCNC(=O)C2=CN3C(=NC4=C(C3=O)C=C(C=C4)O)C=C2

Isomeric SMILES

C1=CC(=CN=C1)CCCCNC(=O)C2=CN3C(=NC4=C(C3=O)C=C(C=C4)O)C=C2

InChI

InChI=1S/C22H20N4O3/c27-17-7-8-19-18(12-17)22(29)26-14-16(6-9-20(26)25-19)21(28)24-11-2-1-4-15-5-3-10-23-13-15/h3,5-10,12-14,27H,1-2,4,11H2,(H,24,28)