2-[5-(3,4-dimethylphenyl)-3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanylethanenitrile

Systemtic Name: 2-[5-(3,4-dimethylphenyl)-3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanylethanenitrile Openeye Name: 2-[5-(3,4-dimethylphenyl)-3-methyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl]sulfanylacetonitrile CAS Name: 2-[[5-(3,4-dimethylphenyl)-3-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]acetonitrile IUPAC Name: 2-[5-(3,4-dimethylphenyl)-3-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl]sulfanylacetonitrile Traditional Name: 2-[[5-(3,4-dimethylphenyl)-4-keto-3-methyl-thieno[2,3-d]pyrimidin-2-yl]thio]acetonitrile Formula: C17H15N3OS2 MolecularWeight: 341.4505

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC#N)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC#N)C)C

InChI

InChI=1S/C17H15N3OS2/c1-10-4-5-12(8-11(10)2)13-9-23-15-14(13)16(21)20(3)17(19-15)22-7-6-18/h4-5,8-9H,7H2,1-3H3