2-(2-methyl-4-pentan-3-yloxy-5,6-dihydropyrrolo[2,3-d]pyrimidin-7-yl)-5-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 2-(2-methyl-4-pentan-3-yloxy-5,6-dihydropyrrolo[2,3-d]pyrimidin-7-yl)-5-(trifluoromethyl)benzenecarbonitrile Openeye Name: 2-[4-(1-ethylpropoxy)-2-methyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-7-yl]-5-(trifluoromethyl)benzonitrile CAS Name: 2-(2-methyl-4-pentan-3-yloxy-5,6-dihydropyrrolo[2,3-d]pyrimidin-7-yl)-5-(trifluoromethyl)benzonitrile IUPAC Name: 2-(2-methyl-4-pentan-3-yloxy-5,6-dihydropyrrolo[2,3-d]pyrimidin-7-yl)-5-(trifluoromethyl)benzonitrile Traditional Name: 2-[4-(1-ethylpropoxy)-2-methyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-7-yl]-5-(trifluoromethyl)benzonitrile Formula: C20H21F3N4O MolecularWeight: 390.40215

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)OC1=NC(=NC2=C1CCN2C3=C(C=C(C=C3)C(F)(F)F)C#N)C

Isomeric SMILES

CCC(CC)OC1=NC(=NC2=C1CCN2C3=C(C=C(C=C3)C(F)(F)F)C#N)C

InChI

InChI=1S/C20H21F3N4O/c1-4-15(5-2)28-19-16-8-9-27(18(16)25-12(3)26-19)17-7-6-14(20(21,22)23)10-13(17)11-24/h6-7,10,15H,4-5,8-9H2,1-3H3