3-(3,5,6-trimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanenitrile

Systemtic Name: 3-(3,5,6-trimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanenitrile Openeye Name: 3-(3,5,6-trimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanenitrile CAS Name: 3-[(3,5,6-trimethyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]propanenitrile IUPAC Name: 3-(3,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanylpropanenitrile Traditional Name: 3-[(4-keto-3,5,6-trimethyl-thieno[2,3-d]pyrimidin-2-yl)thio]propionitrile Formula: C12H13N3OS2 MolecularWeight: 279.38112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCCC#N)C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCCC#N)C)C

InChI

InChI=1S/C12H13N3OS2/c1-7-8(2)18-10-9(7)11(16)15(3)12(14-10)17-6-4-5-13/h4,6H2,1-3H3