2-[(R)-(6-oxidanyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)-phenyl-methyl]propanedinitrile

Systemtic Name: 2-[(R)-(6-oxidanyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)-phenyl-methyl]propanedinitrile Openeye Name: 2-[(R)-(6-hydroxy-4-oxo-2-thioxo-1H-pyrimidin-5-yl)-phenyl-methyl]propanedinitrile CAS Name: 2-[(R)-(6-hydroxy-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)-phenylmethyl]propanedinitrile IUPAC Name: 2-[(R)-(6-hydroxy-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)-phenylmethyl]propanedinitrile Traditional Name: 2-[(R)-(6-hydroxy-4-keto-2-thioxo-1H-pyrimidin-5-yl)-phenyl-methyl]malononitrile Formula: C14H10N4O2S MolecularWeight: 298.3198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=C(NC(=S)NC2=O)O)C(C#N)C#N

Isomeric SMILES

C1=CC=C(C=C1)[C@H](C2=C(NC(=S)NC2=O)O)C(C#N)C#N

InChI

InChI=1S/C14H10N4O2S/c15-6-9(7-16)10(8-4-2-1-3-5-8)11-12(19)17-14(21)18-13(11)20/h1-5,9-10H,(H3,17,18,19,20,21)/t10-/m0/s1