2-(3-nitropyridin-2-yl)sulfanyl-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 2-(3-nitropyridin-2-yl)sulfanyl-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 2-[(3-nitro-2-pyridyl)sulfanyl]-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 2-[(3-nitro-2-pyridinyl)thio]-6-phenyl-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 2-(3-nitropyridin-2-yl)sulfanyl-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-[(3-nitro-2-pyridyl)thio]-6-phenyl-4-(trifluoromethyl)nicotinonitrile Formula: C18H9F3N4O2S MolecularWeight: 402.34987

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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=CC=N3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SC3=C(C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C18H9F3N4O2S/c19-18(20,21)13-9-14(11-5-2-1-3-6-11)24-16(12(13)10-22)28-17-15(25(26)27)7-4-8-23-17/h1-9H