2-[4-(4-quinolin-2-ylpiperazin-1-yl)butyl]-5,6,7,8-tetrahydro-1H-quinazolin-4-one

Systemtic Name: 2-[4-(4-quinolin-2-ylpiperazin-1-yl)butyl]-5,6,7,8-tetrahydro-1H-quinazolin-4-one Openeye Name: 2-[4-[4-(2-quinolyl)piperazin-1-yl]butyl]-5,6,7,8-tetrahydro-1H-quinazolin-4-one CAS Name: 2-[4-[4-(2-quinolinyl)-1-piperazinyl]butyl]-5,6,7,8-tetrahydro-1H-quinazolin-4-one IUPAC Name: 2-[4-(4-quinolin-2-ylpiperazin-1-yl)butyl]-5,6,7,8-tetrahydro-1H-quinazolin-4-one Traditional Name: 2-[4-[4-(2-quinolyl)piperazino]butyl]-5,6,7,8-tetrahydro-1H-quinazolin-4-one Formula: C25H31N5O MolecularWeight: 417.54654

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=O)N=C(N2)CCCCN3CCN(CC3)C4=NC5=CC=CC=C5C=C4

Isomeric SMILES

C1CCC2=C(C1)C(=O)N=C(N2)CCCCN3CCN(CC3)C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C25H31N5O/c31-25-20-8-2-4-10-22(20)26-23(28-25)11-5-6-14-29-15-17-30(18-16-29)24-13-12-19-7-1-3-9-21(19)27-24/h1,3,7,9,12-13H,2,4-6,8,10-11,14-18H2,(H,26,28,31)