3-azanyl-8-chloranyl-2-[4-(4-quinolin-2-ylpiperazin-1-yl)butyl]quinazolin-4-one

Systemtic Name: 3-azanyl-8-chloranyl-2-[4-(4-quinolin-2-ylpiperazin-1-yl)butyl]quinazolin-4-one Openeye Name: 3-amino-8-chloro-2-[4-[4-(2-quinolyl)piperazin-1-yl]butyl]quinazolin-4-one CAS Name: 3-amino-8-chloro-2-[4-[4-(2-quinolinyl)-1-piperazinyl]butyl]-4-quinazolinone IUPAC Name: 3-amino-8-chloro-2-[4-(4-quinolin-2-ylpiperazin-1-yl)butyl]quinazolin-4-one Traditional Name: 3-amino-8-chloro-2-[4-[4-(2-quinolyl)piperazino]butyl]quinazolin-4-one Formula: C25H27ClN6O MolecularWeight: 462.97448

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCC2=NC3=C(C=CC=C3Cl)C(=O)N2N)C4=NC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CCN1CCCCC2=NC3=C(C=CC=C3Cl)C(=O)N2N)C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C25H27ClN6O/c26-20-8-5-7-19-24(20)29-23(32(27)25(19)33)10-3-4-13-30-14-16-31(17-15-30)22-12-11-18-6-1-2-9-21(18)28-22/h1-2,5-9,11-12H,3-4,10,13-17,27H2