6-chloranyl-3-[[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methyl]quinazolin-4-one

Systemtic Name: 6-chloranyl-3-[[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methyl]quinazolin-4-one Openeye Name: 6-chloro-3-[[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]methyl]quinazolin-4-one CAS Name: 6-chloro-3-[[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]methyl]-4-quinazolinone IUPAC Name: 6-chloro-3-[[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methyl]quinazolin-4-one Traditional Name: 6-chloro-3-[[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]methyl]quinazolin-4-one Formula: C19H17ClF3N5O MolecularWeight: 423.81939

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C=NC3=C(C2=O)C=C(C=C3)Cl)C4=NC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CN2C=NC3=C(C2=O)C=C(C=C3)Cl)C4=NC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C19H17ClF3N5O/c20-14-2-3-16-15(9-14)18(29)28(11-25-16)12-26-5-7-27(8-6-26)17-4-1-13(10-24-17)19(21,22)23/h1-4,9-11H,5-8,12H2