phenethyl 3-[(3,4-dichlorophenyl)methyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: phenethyl 3-[(3,4-dichlorophenyl)methyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: phenethyl 3-[(3,4-dichlorophenyl)methyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3-[(3,4-dichlorophenyl)methyl]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid phenethyl ester IUPAC Name: phenethyl 3-[(3,4-dichlorophenyl)methyl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-(3,4-dichlorobenzyl)-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid phenethyl ester Formula: C23H18Cl2N2O3S MolecularWeight: 473.37162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC(=C(C=C3)Cl)Cl)C(=O)OCCC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC(=C(C=C3)Cl)Cl)C(=O)OCCC4=CC=CC=C4

InChI

InChI=1S/C23H18Cl2N2O3S/c1-14-19-21(31-20(14)23(29)30-10-9-15-5-3-2-4-6-15)26-13-27(22(19)28)12-16-7-8-17(24)18(25)11-16/h2-8,11,13H,9-10,12H2,1H3