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

Systemtic Name: 2-[3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanylpropanenitrile Openeye Name: 2-[3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl]sulfanylpropanenitrile CAS Name: 2-[[3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]propanenitrile IUPAC Name: 2-[3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl]sulfanylpropanenitrile Traditional Name: 2-[[3-(3,4-dimethylphenyl)-5-ethyl-4-keto-6-methyl-thieno[2,3-d]pyrimidin-2-yl]thio]propionitrile Formula: C20H21N3OS2 MolecularWeight: 383.53024

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)N(C(=N2)SC(C)C#N)C3=CC(=C(C=C3)C)C)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)N(C(=N2)SC(C)C#N)C3=CC(=C(C=C3)C)C)C

InChI

InChI=1S/C20H21N3OS2/c1-6-16-14(5)26-18-17(16)19(24)23(20(22-18)25-13(4)10-21)15-8-7-11(2)12(3)9-15/h7-9,13H,6H2,1-5H3