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

Systemtic Name: ethyl 5-methyl-3-(naphthalen-1-ylmethyl)-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-3-(1-naphthylmethyl)-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-3-(1-naphthalenylmethyl)-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-3-(naphthalen-1-ylmethyl)-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-3-(1-naphthylmethyl)thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C21H18N2O3S MolecularWeight: 378.44422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CC3=CC=CC4=CC=CC=C43)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CC3=CC=CC4=CC=CC=C43)C

InChI

InChI=1S/C21H18N2O3S/c1-3-26-21(25)18-13(2)17-19(27-18)22-12-23(20(17)24)11-15-9-6-8-14-7-4-5-10-16(14)15/h4-10,12H,3,11H2,1-2H3