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

Systemtic Name: 2-[[2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]methylsulfanyl]-6-(4-chlorophenyl)pyridine-3-carbonitrile Openeye Name: 6-(4-chlorophenyl)-2-[(2,4-dioxo-1H-pyrimidin-6-yl)methylsulfanyl]pyridine-3-carbonitrile CAS Name: 6-(4-chlorophenyl)-2-[(2,4-dioxo-1H-pyrimidin-6-yl)methylthio]-3-pyridinecarbonitrile IUPAC Name: 6-(4-chlorophenyl)-2-[(2,4-dioxo-1H-pyrimidin-6-yl)methylsulfanyl]pyridine-3-carbonitrile Traditional Name: 6-(4-chlorophenyl)-2-[(2,4-diketo-1H-pyrimidin-6-yl)methylthio]nicotinonitrile Formula: C17H11ClN4O2S MolecularWeight: 370.81284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=C(C=C2)C#N)SCC3=CC(=O)NC(=O)N3)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=C(C=C2)C#N)SCC3=CC(=O)NC(=O)N3)Cl

InChI

InChI=1S/C17H11ClN4O2S/c18-12-4-1-10(2-5-12)14-6-3-11(8-19)16(21-14)25-9-13-7-15(23)22-17(24)20-13/h1-7H,9H2,(H2,20,22,23,24)