3-chloranyl-11-oxidanylidene-N-[2-(4-phenylpiperazin-1-yl)ethyl]pyrido[2,1-b]quinazoline-6-carboxamide

Systemtic Name: 3-chloranyl-11-oxidanylidene-N-[2-(4-phenylpiperazin-1-yl)ethyl]pyrido[2,1-b]quinazoline-6-carboxamide Openeye Name: 3-chloro-11-oxo-N-[2-(4-phenylpiperazin-1-yl)ethyl]pyrido[2,1-b]quinazoline-6-carboxamide CAS Name: 3-chloro-11-oxo-N-[2-(4-phenyl-1-piperazinyl)ethyl]-6-pyrido[2,1-b]quinazolinecarboxamide IUPAC Name: 3-chloro-11-oxo-N-[2-(4-phenylpiperazin-1-yl)ethyl]pyrido[2,1-b]quinazoline-6-carboxamide Traditional Name: 3-chloro-11-keto-N-[2-(4-phenylpiperazino)ethyl]pyrido[2,1-b]quinazoline-6-carboxamide Formula: C25H24ClN5O2 MolecularWeight: 461.94336

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)C2=CC=CN3C2=NC4=C(C3=O)C=CC(=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCNC(=O)C2=CC=CN3C2=NC4=C(C3=O)C=CC(=C4)Cl)C5=CC=CC=C5

InChI

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