ethyl 4-oxidanylidene-5-[(E)-2-(2-oxidanylnaphthalen-1-yl)ethenyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-oxidanylidene-5-[(E)-2-(2-oxidanylnaphthalen-1-yl)ethenyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-[(E)-2-(2-hydroxy-1-naphthyl)vinyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-[(E)-2-(2-hydroxy-1-naphthalenyl)ethenyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(E)-2-(2-hydroxynaphthalen-1-yl)ethenyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-[(E)-2-(2-hydroxy-1-naphthyl)vinyl]-4-keto-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C21H16N2O4S MolecularWeight: 392.42774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=CNC2=O)C=CC3=C(C=CC4=CC=CC=C43)O

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=CNC2=O)/C=C/C3=C(C=CC4=CC=CC=C43)O

InChI

InChI=1S/C21H16N2O4S/c1-2-27-21(26)18-15(17-19(25)22-11-23-20(17)28-18)9-8-14-13-6-4-3-5-12(13)7-10-16(14)24/h3-11,24H,2H2,1H3,(H,22,23,25)/b9-8+