3-(4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanenitrile

Systemtic Name: 3-(4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanenitrile Openeye Name: 3-(4-oxo-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanenitrile CAS Name: 3-[(4-oxo-3-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]propanenitrile IUPAC Name: 3-(4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylpropanenitrile Traditional Name: 3-[(4-keto-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]propionitrile Formula: C15H11N3OS2 MolecularWeight: 313.39734

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCCC#N)SC=C3

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCCC#N)SC=C3

InChI

InChI=1S/C15H11N3OS2/c16-8-4-9-21-15-17-13-12(7-10-20-13)14(19)18(15)11-5-2-1-3-6-11/h1-3,5-7,10H,4,9H2