6-(3,4-dimethoxyphenyl)-2-(2-ethoxyethylsulfanyl)-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 6-(3,4-dimethoxyphenyl)-2-(2-ethoxyethylsulfanyl)-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 6-(3,4-dimethoxyphenyl)-2-(2-ethoxyethylsulfanyl)-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 6-(3,4-dimethoxyphenyl)-2-(2-ethoxyethylthio)-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 6-(3,4-dimethoxyphenyl)-2-(2-ethoxyethylsulfanyl)-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 6-(3,4-dimethoxyphenyl)-2-(2-ethoxyethylthio)-4-(trifluoromethyl)nicotinonitrile Formula: C19H19F3N2O3S MolecularWeight: 412.42597

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCSC1=C(C(=CC(=N1)C2=CC(=C(C=C2)OC)OC)C(F)(F)F)C#N

Isomeric SMILES

CCOCCSC1=C(C(=CC(=N1)C2=CC(=C(C=C2)OC)OC)C(F)(F)F)C#N

InChI

InChI=1S/C19H19F3N2O3S/c1-4-27-7-8-28-18-13(11-23)14(19(20,21)22)10-15(24-18)12-5-6-16(25-2)17(9-12)26-3/h5-6,9-10H,4,7-8H2,1-3H3