2-[4-[4-(4-chloranylquinolin-2-yl)piperazin-1-yl]butyl]-6-methoxy-3-methyl-quinazolin-4-one

Systemtic Name: 2-[4-[4-(4-chloranylquinolin-2-yl)piperazin-1-yl]butyl]-6-methoxy-3-methyl-quinazolin-4-one Openeye Name: 2-[4-[4-(4-chloro-2-quinolyl)piperazin-1-yl]butyl]-6-methoxy-3-methyl-quinazolin-4-one CAS Name: 2-[4-[4-(4-chloro-2-quinolinyl)-1-piperazinyl]butyl]-6-methoxy-3-methyl-4-quinazolinone IUPAC Name: 2-[4-[4-(4-chloroquinolin-2-yl)piperazin-1-yl]butyl]-6-methoxy-3-methylquinazolin-4-one Traditional Name: 2-[4-[4-(4-chloro-2-quinolyl)piperazino]butyl]-6-methoxy-3-methyl-quinazolin-4-one Formula: C27H30ClN5O2 MolecularWeight: 492.0124

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=C(C1=O)C=C(C=C2)OC)CCCCN3CCN(CC3)C4=NC5=CC=CC=C5C(=C4)Cl

Isomeric SMILES

CN1C(=NC2=C(C1=O)C=C(C=C2)OC)CCCCN3CCN(CC3)C4=NC5=CC=CC=C5C(=C4)Cl

InChI

InChI=1S/C27H30ClN5O2/c1-31-25(29-24-11-10-19(35-2)17-21(24)27(31)34)9-5-6-12-32-13-15-33(16-14-32)26-18-22(28)20-7-3-4-8-23(20)30-26/h3-4,7-8,10-11,17-18H,5-6,9,12-16H2,1-2H3