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

Systemtic Name: 2-phenoxyethyl 5-methyl-4-oxidanylidene-3-(3-phenylpropyl)thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 2-phenoxyethyl 5-methyl-4-oxo-3-(3-phenylpropyl)thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-(3-phenylpropyl)-6-thieno[2,3-d]pyrimidinecarboxylic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 5-methyl-4-oxo-3-(3-phenylpropyl)thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-3-(3-phenylpropyl)thieno[2,3-d]pyrimidine-6-carboxylic acid 2-phenoxyethyl ester Formula: C25H24N2O4S MolecularWeight: 448.53406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CCCC3=CC=CC=C3)C(=O)OCCOC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CCCC3=CC=CC=C3)C(=O)OCCOC4=CC=CC=C4

InChI

InChI=1S/C25H24N2O4S/c1-18-21-23(26-17-27(24(21)28)14-8-11-19-9-4-2-5-10-19)32-22(18)25(29)31-16-15-30-20-12-6-3-7-13-20/h2-7,9-10,12-13,17H,8,11,14-16H2,1H3