methyl 5-(2-methoxy-2-oxidanylidene-ethyl)-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: methyl 5-(2-methoxy-2-oxidanylidene-ethyl)-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 5-(2-methoxy-2-oxo-ethyl)-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-(2-methoxy-2-oxoethyl)-2-[[(4-methyl-6-phenyl-2-pyrimidinyl)thio]methyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 5-(2-methoxy-2-oxoethyl)-2-[(4-methyl-6-phenylpyrimidin-2-yl)sulfanylmethyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-(2-keto-2-methoxy-ethyl)-2-[[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]methyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C23H20N4O5S2 MolecularWeight: 496.5587

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=NC4=C(C(=C(S4)C(=O)OC)CC(=O)OC)C(=O)N3

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=NC4=C(C(=C(S4)C(=O)OC)CC(=O)OC)C(=O)N3

InChI

InChI=1S/C23H20N4O5S2/c1-12-9-15(13-7-5-4-6-8-13)25-23(24-12)33-11-16-26-20(29)18-14(10-17(28)31-2)19(22(30)32-3)34-21(18)27-16/h4-9H,10-11H2,1-3H3,(H,26,27,29)