2,3-dimethyl-N-[4-(1-methylpyrimidin-1-ium-5-yl)butyl]-11-oxidanylidene-pyrido[2,1-b]quinazoline-8-carboxamide

Systemtic Name: 2,3-dimethyl-N-[4-(1-methylpyrimidin-1-ium-5-yl)butyl]-11-oxidanylidene-pyrido[2,1-b]quinazoline-8-carboxamide Openeye Name: 2,3-dimethyl-N-[4-(1-methylpyrimidin-1-ium-5-yl)butyl]-11-oxo-pyrido[2,1-b]quinazoline-8-carboxamide CAS Name: 2,3-dimethyl-N-[4-(1-methyl-5-pyrimidin-1-iumyl)butyl]-11-oxo-8-pyrido[2,1-b]quinazolinecarboxamide IUPAC Name: 2,3-dimethyl-N-[4-(1-methylpyrimidin-1-ium-5-yl)butyl]-11-oxopyrido[2,1-b]quinazoline-8-carboxamide Traditional Name: 11-keto-2,3-dimethyl-N-[4-(1-methylpyrimidin-1-ium-5-yl)butyl]pyrido[2,1-b]quinazoline-8-carboxamide Formula: C24H26N5O2+ MolecularWeight: 416.49554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)N3C=C(C=CC3=N2)C(=O)NCCCCC4=CN=C[N+](=C4)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)N3C=C(C=CC3=N2)C(=O)NCCCCC4=CN=C[N+](=C4)C)C

InChI

InChI=1S/C24H25N5O2/c1-16-10-20-21(11-17(16)2)27-22-8-7-19(14-29(22)24(20)31)23(30)26-9-5-4-6-18-12-25-15-28(3)13-18/h7-8,10-15H,4-6,9H2,1-3H3/p+1