3-chloranyl-11-oxidanylidene-N-[2-(4-phenylpiperazin-1-yl)ethyl]pyrido[2,1-b]quinazoline-8-carboxamide

Systemtic Name: 3-chloranyl-11-oxidanylidene-N-[2-(4-phenylpiperazin-1-yl)ethyl]pyrido[2,1-b]quinazoline-8-carboxamide Openeye Name: 3-chloro-11-oxo-N-[2-(4-phenylpiperazin-1-yl)ethyl]pyrido[2,1-b]quinazoline-8-carboxamide CAS Name: 3-chloro-11-oxo-N-[2-(4-phenyl-1-piperazinyl)ethyl]-8-pyrido[2,1-b]quinazolinecarboxamide IUPAC Name: 3-chloro-11-oxo-N-[2-(4-phenylpiperazin-1-yl)ethyl]pyrido[2,1-b]quinazoline-8-carboxamide Traditional Name: 3-chloro-11-keto-N-[2-(4-phenylpiperazino)ethyl]pyrido[2,1-b]quinazoline-8-carboxamide Formula: C25H24ClN5O2 MolecularWeight: 461.94336

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)C2=CN3C(=NC4=C(C3=O)C=CC(=C4)Cl)C=C2)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCNC(=O)C2=CN3C(=NC4=C(C3=O)C=CC(=C4)Cl)C=C2)C5=CC=CC=C5

InChI

InChI=1S/C25H24ClN5O2/c26-19-7-8-21-22(16-19)28-23-9-6-18(17-31(23)25(21)33)24(32)27-10-11-29-12-14-30(15-13-29)20-4-2-1-3-5-20/h1-9,16-17H,10-15H2,(H,27,32)