3-[[5-chloranyl-3-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]methylideneamino]-2-methyl-quinazolin-4-one

Systemtic Name: 3-[[5-chloranyl-3-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]methylideneamino]-2-methyl-quinazolin-4-one Openeye Name: 3-[[5-chloro-3-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]methyleneamino]-2-methyl-quinazolin-4-one CAS Name: 3-[[5-chloro-3-methyl-1-[3-(trifluoromethyl)phenyl]-4-pyrazolyl]methylideneamino]-2-methyl-4-quinazolinone IUPAC Name: 3-[[5-chloro-3-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]methylideneamino]-2-methylquinazolin-4-one Traditional Name: 3-[[5-chloro-3-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]methyleneamino]-2-methyl-quinazolin-4-one Formula: C21H15ClF3N5O MolecularWeight: 445.82491

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NN2C(=NC3=CC=CC=C3C2=O)C)Cl)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CC1=NN(C(=C1C=NN2C(=NC3=CC=CC=C3C2=O)C)Cl)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C21H15ClF3N5O/c1-12-17(11-26-29-13(2)27-18-9-4-3-8-16(18)20(29)31)19(22)30(28-12)15-7-5-6-14(10-15)21(23,24)25/h3-11H,1-2H3