2-chloranyl-8-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-pyrido[2,1-b]quinazolin-11-one

Systemtic Name: 2-chloranyl-8-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-pyrido[2,1-b]quinazolin-11-one Openeye Name: 2-chloro-8-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyrido[2,1-b]quinazolin-11-one CAS Name: 2-chloro-8-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-11-pyrido[2,1-b]quinazolinone IUPAC Name: 2-chloro-8-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyrido[2,1-b]quinazolin-11-one Traditional Name: 2-chloro-8-[4-(2-pyrimidyl)piperazine-1-carbonyl]pyrido[2,1-b]quinazolin-11-one Formula: C21H17ClN6O2 MolecularWeight: 420.85168

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CN4C(=NC5=C(C4=O)C=C(C=C5)Cl)C=C3

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CN4C(=NC5=C(C4=O)C=C(C=C5)Cl)C=C3

InChI

InChI=1S/C21H17ClN6O2/c22-15-3-4-17-16(12-15)20(30)28-13-14(2-5-18(28)25-17)19(29)26-8-10-27(11-9-26)21-23-6-1-7-24-21/h1-7,12-13H,8-11H2