2-[[5-(3,4-dimethylphenyl)-6-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[5-(3,4-dimethylphenyl)-6-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]ethanoate Openeye Name: 2-[[5-(3,4-dimethylphenyl)-6-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]acetate CAS Name: 2-[[5-(3,4-dimethylphenyl)-6-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]thio]acetate IUPAC Name: 2-[[5-(3,4-dimethylphenyl)-6-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-(3,4-dimethylphenyl)-4-keto-6-methyl-3H-thieno[2,3-d]pyrimidin-2-yl]thio]acetate Formula: C17H15N2O3S2- MolecularWeight: 359.4426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(SC3=C2C(=O)NC(=N3)SCC(=O)[O-])C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(SC3=C2C(=O)NC(=N3)SCC(=O)[O-])C)C

InChI

InChI=1S/C17H16N2O3S2/c1-8-4-5-11(6-9(8)2)13-10(3)24-16-14(13)15(22)18-17(19-16)23-7-12(20)21/h4-6H,7H2,1-3H3,(H,20,21)(H,18,19,22)/p-1