2-(2-methanoyl-4-nitro-phenyl)sulfanyl-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 2-(2-methanoyl-4-nitro-phenyl)sulfanyl-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 2-(2-formyl-4-nitro-phenyl)sulfanyl-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 2-[(2-formyl-4-nitrophenyl)thio]-6-phenyl-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 2-(2-formyl-4-nitrophenyl)sulfanyl-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-[(2-formyl-4-nitro-phenyl)thio]-6-phenyl-4-(trifluoromethyl)nicotinonitrile Formula: C20H10F3N3O3S MolecularWeight: 429.37191

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SC3=C(C=C(C=C3)[N+](=O)[O-])C=O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SC3=C(C=C(C=C3)[N+](=O)[O-])C=O

InChI

InChI=1S/C20H10F3N3O3S/c21-20(22,23)16-9-17(12-4-2-1-3-5-12)25-19(15(16)10-24)30-18-7-6-14(26(28)29)8-13(18)11-27/h1-9,11H