2-phenoxyethyl 2-ethyl-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 2-phenoxyethyl 2-ethyl-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 2-phenoxyethyl 2-ethyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-ethyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 2-ethyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-ethyl-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid 2-phenoxyethyl ester Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C(=C(S2)C(=O)OCCOC3=CC=CC=C3)C)C(=O)N1

Isomeric SMILES

CCC1=NC2=C(C(=C(S2)C(=O)OCCOC3=CC=CC=C3)C)C(=O)N1

InChI

InChI=1S/C18H18N2O4S/c1-3-13-19-16(21)14-11(2)15(25-17(14)20-13)18(22)24-10-9-23-12-7-5-4-6-8-12/h4-8H,3,9-10H2,1-2H3,(H,19,20,21)