N-[2-(4-methylpiperazin-1-yl)ethyl]-11-oxidanylidene-2-propan-2-yl-pyrido[2,1-b]quinazoline-8-carboxamide trihydrochloride

Systemtic Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-11-oxidanylidene-2-propan-2-yl-pyrido[2,1-b]quinazoline-8-carboxamide trihydrochloride Openeye Name: 2-isopropyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-11-oxo-pyrido[2,1-b]quinazoline-8-carboxamide trihydrochloride CAS Name: N-[2-(4-methyl-1-piperazinyl)ethyl]-11-oxo-2-propan-2-yl-8-pyrido[2,1-b]quinazolinecarboxamide trihydrochloride IUPAC Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-11-oxo-2-propan-2-ylpyrido[2,1-b]quinazoline-8-carboxamide trihydrochloride Traditional Name: 2-isopropyl-11-keto-N-[2-(4-methylpiperazino)ethyl]pyrido[2,1-b]quinazoline-8-carboxamide trihydrochloride Formula: C23H32Cl3N5O2 MolecularWeight: 516.89148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)N=C3C=CC(=CN3C2=O)C(=O)NCCN4CCN(CC4)C.Cl.Cl.Cl

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)N=C3C=CC(=CN3C2=O)C(=O)NCCN4CCN(CC4)C.Cl.Cl.Cl

InChI

InChI=1S/C23H29N5O2.3ClH/c1-16(2)17-4-6-20-19(14-17)23(30)28-15-18(5-7-21(28)25-20)22(29)24-8-9-27-12-10-26(3)11-13-27;;;/h4-7,14-16H,8-13H2,1-3H3,(H,24,29);3*1H