ethyl 2-[6-[(2-methoxyphenyl)carbamoyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]butanoate

Systemtic Name: ethyl 2-[6-[(2-methoxyphenyl)carbamoyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]butanoate Openeye Name: ethyl 2-[6-[(2-methoxyphenyl)carbamoyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl]butanoate CAS Name: 2-[6-[(2-methoxyanilino)-oxomethyl]-5-methyl-4-oxo-3-thieno[2,3-d]pyrimidinyl]butanoic acid ethyl ester IUPAC Name: ethyl 2-[6-[(2-methoxyphenyl)carbamoyl]-5-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl]butanoate Traditional Name: 2-[4-keto-6-[(2-methoxyphenyl)carbamoyl]-5-methyl-thieno[2,3-d]pyrimidin-3-yl]butyric acid ethyl ester Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC)N1C=NC2=C(C1=O)C(=C(S2)C(=O)NC3=CC=CC=C3OC)C

Isomeric SMILES

CCC(C(=O)OCC)N1C=NC2=C(C1=O)C(=C(S2)C(=O)NC3=CC=CC=C3OC)C

InChI

InChI=1S/C21H23N3O5S/c1-5-14(21(27)29-6-2)24-11-22-19-16(20(24)26)12(3)17(30-19)18(25)23-13-9-7-8-10-15(13)28-4/h7-11,14H,5-6H2,1-4H3,(H,23,25)