2-[2-[[3-chloranyl-2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]methyl]-4-oxidanylidene-quinazolin-3-yl]ethanenitrile

Systemtic Name: 2-[2-[[3-chloranyl-2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]methyl]-4-oxidanylidene-quinazolin-3-yl]ethanenitrile Openeye Name: 2-[2-[[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridyl]methyl]-4-oxo-quinazolin-3-yl]acetonitrile CAS Name: 2-[2-[[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]methyl]-4-oxo-3-quinazolinyl]acetonitrile IUPAC Name: 2-[2-[[3-chloro-2-oxo-5-(trifluoromethyl)pyridin-1-yl]methyl]-4-oxoquinazolin-3-yl]acetonitrile Traditional Name: 2-[2-[[3-chloro-2-keto-5-(trifluoromethyl)-1-pyridyl]methyl]-4-keto-quinazolin-3-yl]acetonitrile Formula: C17H10ClF3N4O2 MolecularWeight: 394.73511

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)CN3C=C(C=C(C3=O)Cl)C(F)(F)F)CC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)CN3C=C(C=C(C3=O)Cl)C(F)(F)F)CC#N

InChI

InChI=1S/C17H10ClF3N4O2/c18-12-7-10(17(19,20)21)8-24(16(12)27)9-14-23-13-4-2-1-3-11(13)15(26)25(14)6-5-22/h1-4,7-8H,6,9H2