1-[(2,4-dimethylphenyl)methyl]-6-(3-methyl-4-pyrazin-2-yloxy-phenyl)-2-oxidanylidene-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 1-[(2,4-dimethylphenyl)methyl]-6-(3-methyl-4-pyrazin-2-yloxy-phenyl)-2-oxidanylidene-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 1-[(2,4-dimethylphenyl)methyl]-6-(3-methyl-4-pyrazin-2-yloxy-phenyl)-2-oxo-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 1-[(2,4-dimethylphenyl)methyl]-6-[3-methyl-4-(2-pyrazinyloxy)phenyl]-2-oxo-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 1-[(2,4-dimethylphenyl)methyl]-6-(3-methyl-4-pyrazin-2-yloxyphenyl)-2-oxo-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 1-(2,4-dimethylbenzyl)-2-keto-6-(3-methyl-4-pyrazin-2-yloxy-phenyl)-4-(trifluoromethyl)nicotinonitrile Formula: C27H21F3N4O2 MolecularWeight: 490.47645

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CN2C(=CC(=C(C2=O)C#N)C(F)(F)F)C3=CC(=C(C=C3)OC4=NC=CN=C4)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)CN2C(=CC(=C(C2=O)C#N)C(F)(F)F)C3=CC(=C(C=C3)OC4=NC=CN=C4)C)C

InChI

InChI=1S/C27H21F3N4O2/c1-16-4-5-20(17(2)10-16)15-34-23(12-22(27(28,29)30)21(13-31)26(34)35)19-6-7-24(18(3)11-19)36-25-14-32-8-9-33-25/h4-12,14H,15H2,1-3H3