2-[[2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]methylsulfanyl]-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 2-[[2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]methylsulfanyl]-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 2-[(2,4-dioxo-1H-pyrimidin-6-yl)methylsulfanyl]-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 2-[(2,4-dioxo-1H-pyrimidin-6-yl)methylthio]-6-phenyl-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 2-[(2,4-dioxo-1H-pyrimidin-6-yl)methylsulfanyl]-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-[(2,4-diketo-1H-pyrimidin-6-yl)methylthio]-6-phenyl-4-(trifluoromethyl)nicotinonitrile Formula: C18H11F3N4O2S MolecularWeight: 404.36575

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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)SCC3=CC(=O)NC(=O)N3

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCC3=CC(=O)NC(=O)N3

InChI

InChI=1S/C18H11F3N4O2S/c19-18(20,21)13-7-14(10-4-2-1-3-5-10)24-16(12(13)8-22)28-9-11-6-15(26)25-17(27)23-11/h1-7H,9H2,(H2,23,25,26,27)