3-[[4-[4-(3-chlorophenyl)piperazin-1-yl]carbonylcyclohexyl]methyl]quinazolin-4-one

Systemtic Name: 3-[[4-[4-(3-chlorophenyl)piperazin-1-yl]carbonylcyclohexyl]methyl]quinazolin-4-one Openeye Name: 3-[[4-[4-(3-chlorophenyl)piperazine-1-carbonyl]cyclohexyl]methyl]quinazolin-4-one CAS Name: 3-[[4-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]cyclohexyl]methyl]-4-quinazolinone IUPAC Name: 3-[[4-[4-(3-chlorophenyl)piperazine-1-carbonyl]cyclohexyl]methyl]quinazolin-4-one Traditional Name: 3-[[4-[4-(3-chlorophenyl)piperazine-1-carbonyl]cyclohexyl]methyl]quinazolin-4-one Formula: C26H29ClN4O2 MolecularWeight: 464.98706

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN2C=NC3=CC=CC=C3C2=O)C(=O)N4CCN(CC4)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1CC(CCC1CN2C=NC3=CC=CC=C3C2=O)C(=O)N4CCN(CC4)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C26H29ClN4O2/c27-21-4-3-5-22(16-21)29-12-14-30(15-13-29)25(32)20-10-8-19(9-11-20)17-31-18-28-24-7-2-1-6-23(24)26(31)33/h1-7,16,18-20H,8-15,17H2