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

Systemtic Name: 2-[5-(3,4-dimethylphenyl)-6-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanoate Openeye Name: 2-[5-(3,4-dimethylphenyl)-6-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl]acetate CAS Name: 2-[5-(3,4-dimethylphenyl)-6-methyl-4-oxo-3-thieno[2,3-d]pyrimidinyl]acetate IUPAC Name: 2-[5-(3,4-dimethylphenyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl]acetate Traditional Name: 2-[5-(3,4-dimethylphenyl)-4-keto-6-methyl-thieno[2,3-d]pyrimidin-3-yl]acetate Formula: C17H15N2O3S- MolecularWeight: 327.3776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(SC3=C2C(=O)N(C=N3)CC(=O)[O-])C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(SC3=C2C(=O)N(C=N3)CC(=O)[O-])C)C

InChI

InChI=1S/C17H16N2O3S/c1-9-4-5-12(6-10(9)2)14-11(3)23-16-15(14)17(22)19(8-18-16)7-13(20)21/h4-6,8H,7H2,1-3H3,(H,20,21)/p-1