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

Systemtic Name: 6-oxidanylidene-3-phenyl-4-sulfanyl-2-thiophen-2-yl-1,2-dihydropyrimidine-5-carbonitrile Openeye Name: 6-oxo-3-phenyl-4-sulfanyl-2-(2-thienyl)-1,2-dihydropyrimidine-5-carbonitrile CAS Name: 4-mercapto-6-oxo-3-phenyl-2-thiophen-2-yl-1,2-dihydropyrimidine-5-carbonitrile IUPAC Name: 6-oxo-3-phenyl-4-sulfanyl-2-thiophen-2-yl-1,2-dihydropyrimidine-5-carbonitrile Traditional Name: 6-keto-4-mercapto-3-phenyl-2-(2-thienyl)-1,2-dihydropyrimidine-5-carbonitrile Formula: C15H11N3OS2 MolecularWeight: 313.39734

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(NC(=O)C(=C2S)C#N)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)N2C(NC(=O)C(=C2S)C#N)C3=CC=CS3

InChI

InChI=1S/C15H11N3OS2/c16-9-11-14(19)17-13(12-7-4-8-21-12)18(15(11)20)10-5-2-1-3-6-10/h1-8,13,20H,(H,17,19)