5,6-dimethyl-2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-[2-oxo-2-(p-tolyl)ethyl]sulfanyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[[2-(4-methylphenyl)-2-oxoethyl]thio]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[2-keto-2-(p-tolyl)ethyl]thio]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C17H16N2O2S2 MolecularWeight: 344.45114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=NC3=C(C(=C(S3)C)C)C(=O)N2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=NC3=C(C(=C(S3)C)C)C(=O)N2

InChI

InChI=1S/C17H16N2O2S2/c1-9-4-6-12(7-5-9)13(20)8-22-17-18-15(21)14-10(2)11(3)23-16(14)19-17/h4-7H,8H2,1-3H3,(H,18,19,21)