(phenylmethyl) 5-methyl-3-(2-naphthalen-1-yloxyethyl)-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: (phenylmethyl) 5-methyl-3-(2-naphthalen-1-yloxyethyl)-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: benzyl 5-methyl-3-[2-(1-naphthyloxy)ethyl]-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-3-[2-(1-naphthalenyloxy)ethyl]-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-methyl-3-(2-naphthalen-1-yloxyethyl)-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-3-[2-(1-naphthoxy)ethyl]thieno[2,3-d]pyrimidine-6-carboxylic acid benzyl ester Formula: C27H22N2O4S MolecularWeight: 470.53958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CCOC3=CC=CC4=CC=CC=C43)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CCOC3=CC=CC4=CC=CC=C43)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C27H22N2O4S/c1-18-23-25(34-24(18)27(31)33-16-19-8-3-2-4-9-19)28-17-29(26(23)30)14-15-32-22-13-7-11-20-10-5-6-12-21(20)22/h2-13,17H,14-16H2,1H3