2-methyl-3-[4-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-4-oxidanylidene-butyl]quinazolin-4-one

Systemtic Name: 2-methyl-3-[4-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-4-oxidanylidene-butyl]quinazolin-4-one Openeye Name: 2-methyl-3-[4-[4-(o-tolylmethyl)piperazin-1-yl]-4-oxo-butyl]quinazolin-4-one CAS Name: 2-methyl-3-[4-[4-[(2-methylphenyl)methyl]-1-piperazinyl]-4-oxobutyl]-4-quinazolinone IUPAC Name: 2-methyl-3-[4-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-4-oxobutyl]quinazolin-4-one Traditional Name: 3-[4-keto-4-[4-(2-methylbenzyl)piperazino]butyl]-2-methyl-quinazolin-4-one Formula: C25H30N4O2 MolecularWeight: 418.5313

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C(=O)CCCN3C(=NC4=CC=CC=C4C3=O)C

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C(=O)CCCN3C(=NC4=CC=CC=C4C3=O)C

InChI

InChI=1S/C25H30N4O2/c1-19-8-3-4-9-21(19)18-27-14-16-28(17-15-27)24(30)12-7-13-29-20(2)26-23-11-6-5-10-22(23)25(29)31/h3-6,8-11H,7,12-18H2,1-2H3