3-ethyl-6-oxidanylidene-2-phenyl-4-sulfanyl-1,2-dihydropyrimidine-5-carbonitrile

Systemtic Name: 3-ethyl-6-oxidanylidene-2-phenyl-4-sulfanyl-1,2-dihydropyrimidine-5-carbonitrile Openeye Name: 3-ethyl-6-oxo-2-phenyl-4-sulfanyl-1,2-dihydropyrimidine-5-carbonitrile CAS Name: 3-ethyl-4-mercapto-6-oxo-2-phenyl-1,2-dihydropyrimidine-5-carbonitrile IUPAC Name: 3-ethyl-6-oxo-2-phenyl-4-sulfanyl-1,2-dihydropyrimidine-5-carbonitrile Traditional Name: 3-ethyl-6-keto-4-mercapto-2-phenyl-1,2-dihydropyrimidine-5-carbonitrile Formula: C13H13N3OS MolecularWeight: 259.32682

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(NC(=O)C(=C1S)C#N)C2=CC=CC=C2

Isomeric SMILES

CCN1C(NC(=O)C(=C1S)C#N)C2=CC=CC=C2

InChI

InChI=1S/C13H13N3OS/c1-2-16-11(9-6-4-3-5-7-9)15-12(17)10(8-14)13(16)18/h3-7,11,18H,2H2,1H3,(H,15,17)