(phenylmethyl) 1-methyl-2,4-bis(oxidanylidene)-3-phenethyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: (phenylmethyl) 1-methyl-2,4-bis(oxidanylidene)-3-phenethyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: benzyl 1-methyl-2,4-dioxo-3-phenethyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 1-methyl-2,4-dioxo-3-phenethyl-6-thieno[2,3-d]pyrimidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-methyl-2,4-dioxo-3-phenethylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2,4-diketo-1-methyl-3-phenethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid benzyl ester Formula: C23H20N2O4S MolecularWeight: 420.4809

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(S2)C(=O)OCC3=CC=CC=C3)C(=O)N(C1=O)CCC4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C=C(S2)C(=O)OCC3=CC=CC=C3)C(=O)N(C1=O)CCC4=CC=CC=C4

InChI

InChI=1S/C23H20N2O4S/c1-24-21-18(14-19(30-21)22(27)29-15-17-10-6-3-7-11-17)20(26)25(23(24)28)13-12-16-8-4-2-5-9-16/h2-11,14H,12-13,15H2,1H3