1-[(3-chlorophenyl)methyl]-5-piperazin-1-yl-7-(trifluoromethyl)-3,4-dihydroquinazolin-2-one

Systemtic Name: 1-[(3-chlorophenyl)methyl]-5-piperazin-1-yl-7-(trifluoromethyl)-3,4-dihydroquinazolin-2-one Openeye Name: 1-[(3-chlorophenyl)methyl]-5-piperazin-1-yl-7-(trifluoromethyl)-3,4-dihydroquinazolin-2-one CAS Name: 1-[(3-chlorophenyl)methyl]-5-(1-piperazinyl)-7-(trifluoromethyl)-3,4-dihydroquinazolin-2-one IUPAC Name: 1-[(3-chlorophenyl)methyl]-5-piperazin-1-yl-7-(trifluoromethyl)-3,4-dihydroquinazolin-2-one Traditional Name: 1-(3-chlorobenzyl)-5-piperazino-7-(trifluoromethyl)-3,4-dihydroquinazolin-2-one Formula: C20H20ClF3N4O MolecularWeight: 424.84721

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC(=CC3=C2CNC(=O)N3CC4=CC(=CC=C4)Cl)C(F)(F)F

Isomeric SMILES

C1CN(CCN1)C2=CC(=CC3=C2CNC(=O)N3CC4=CC(=CC=C4)Cl)C(F)(F)F

InChI

InChI=1S/C20H20ClF3N4O/c21-15-3-1-2-13(8-15)12-28-18-10-14(20(22,23)24)9-17(16(18)11-26-19(28)29)27-6-4-25-5-7-27/h1-3,8-10,25H,4-7,11-12H2,(H,26,29)