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

Systemtic Name: 2-[4-[4-(4-chloranylquinolin-2-yl)piperazin-1-yl]butyl]-3-ethyl-6-methyl-quinazolin-4-one Openeye Name: 2-[4-[4-(4-chloro-2-quinolyl)piperazin-1-yl]butyl]-3-ethyl-6-methyl-quinazolin-4-one CAS Name: 2-[4-[4-(4-chloro-2-quinolinyl)-1-piperazinyl]butyl]-3-ethyl-6-methyl-4-quinazolinone IUPAC Name: 2-[4-[4-(4-chloroquinolin-2-yl)piperazin-1-yl]butyl]-3-ethyl-6-methylquinazolin-4-one Traditional Name: 2-[4-[4-(4-chloro-2-quinolyl)piperazino]butyl]-3-ethyl-6-methyl-quinazolin-4-one Formula: C28H32ClN5O MolecularWeight: 490.03958

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC2=C(C1=O)C=C(C=C2)C)CCCCN3CCN(CC3)C4=NC5=CC=CC=C5C(=C4)Cl

Isomeric SMILES

CCN1C(=NC2=C(C1=O)C=C(C=C2)C)CCCCN3CCN(CC3)C4=NC5=CC=CC=C5C(=C4)Cl

InChI

InChI=1S/C28H32ClN5O/c1-3-34-26(30-25-12-11-20(2)18-22(25)28(34)35)10-6-7-13-32-14-16-33(17-15-32)27-19-23(29)21-8-4-5-9-24(21)31-27/h4-5,8-9,11-12,18-19H,3,6-7,10,13-17H2,1-2H3