phenethyl 5-methyl-2-(naphthalen-1-ylmethyl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: phenethyl 5-methyl-2-(naphthalen-1-ylmethyl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: phenethyl 5-methyl-2-(1-naphthylmethyl)-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-2-(1-naphthalenylmethyl)-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid phenethyl ester IUPAC Name: phenethyl 5-methyl-2-(naphthalen-1-ylmethyl)-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-2-(1-naphthylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid phenethyl ester Formula: C27H22N2O3S MolecularWeight: 454.54018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CC3=CC=CC4=CC=CC=C43)C(=O)OCCC5=CC=CC=C5

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CC3=CC=CC4=CC=CC=C43)C(=O)OCCC5=CC=CC=C5

InChI

InChI=1S/C27H22N2O3S/c1-17-23-25(30)28-22(16-20-12-7-11-19-10-5-6-13-21(19)20)29-26(23)33-24(17)27(31)32-15-14-18-8-3-2-4-9-18/h2-13H,14-16H2,1H3,(H,28,29,30)