3-azanyl-2-[4-[4-(4,8-dimethylquinolin-2-yl)piperazin-1-yl]butyl]quinazolin-4-one

Systemtic Name: 3-azanyl-2-[4-[4-(4,8-dimethylquinolin-2-yl)piperazin-1-yl]butyl]quinazolin-4-one Openeye Name: 3-amino-2-[4-[4-(4,8-dimethyl-2-quinolyl)piperazin-1-yl]butyl]quinazolin-4-one CAS Name: 3-amino-2-[4-[4-(4,8-dimethyl-2-quinolinyl)-1-piperazinyl]butyl]-4-quinazolinone IUPAC Name: 3-amino-2-[4-[4-(4,8-dimethylquinolin-2-yl)piperazin-1-yl]butyl]quinazolin-4-one Traditional Name: 3-amino-2-[4-[4-(4,8-dimethyl-2-quinolyl)piperazino]butyl]quinazolin-4-one Formula: C27H32N6O MolecularWeight: 456.58258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)N3CCN(CC3)CCCCC4=NC5=CC=CC=C5C(=O)N4N

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)N3CCN(CC3)CCCCC4=NC5=CC=CC=C5C(=O)N4N

InChI

InChI=1S/C27H32N6O/c1-19-8-7-10-21-20(2)18-25(30-26(19)21)32-16-14-31(15-17-32)13-6-5-12-24-29-23-11-4-3-9-22(23)27(34)33(24)28/h3-4,7-11,18H,5-6,12-17,28H2,1-2H3