5-methyl-2-(3-methylphenyl)-3-[(2R)-1-oxidanidyl-1-oxidanylidene-propan-2-yl]-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 5-methyl-2-(3-methylphenyl)-3-[(2R)-1-oxidanidyl-1-oxidanylidene-propan-2-yl]-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 5-methyl-3-[(1R)-1-methyl-2-oxido-2-oxo-ethyl]-2-(m-tolyl)-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-2-(3-methylphenyl)-3-[(2R)-1-oxido-1-oxopropan-2-yl]-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylate IUPAC Name: 5-methyl-2-(3-methylphenyl)-3-[(2R)-1-oxido-1-oxopropan-2-yl]-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-3-[(1R)-2-keto-1-methyl-2-oxido-ethyl]-5-methyl-2-(m-tolyl)thieno[2,3-d]pyrimidine-6-carboxylate Formula: C18H14N2O5S-2 MolecularWeight: 370.37916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC3=C(C(=C(S3)C(=O)[O-])C)C(=O)N2C(C)C(=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC3=C(C(=C(S3)C(=O)[O-])C)C(=O)N2[C@H](C)C(=O)[O-]

InChI

InChI=1S/C18H16N2O5S/c1-8-5-4-6-11(7-8)14-19-15-12(9(2)13(26-15)18(24)25)16(21)20(14)10(3)17(22)23/h4-7,10H,1-3H3,(H,22,23)(H,24,25)/p-2/t10-/m1/s1