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

Systemtic Name: phenethyl 2-(diphenylmethyl)-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: phenethyl 2-benzhydryl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-(diphenylmethyl)-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid phenethyl ester IUPAC Name: phenethyl 2-benzhydryl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-benzhydryl-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid phenethyl ester Formula: C29H24N2O3S MolecularWeight: 480.57746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)C(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OCCC5=CC=CC=C5

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)C(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OCCC5=CC=CC=C5

InChI

InChI=1S/C29H24N2O3S/c1-19-23-27(32)30-26(24(21-13-7-3-8-14-21)22-15-9-4-10-16-22)31-28(23)35-25(19)29(33)34-18-17-20-11-5-2-6-12-20/h2-16,24H,17-18H2,1H3,(H,30,31,32)