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

Systemtic Name: butyl 2-[6-ethyl-3-(3-methoxyphenyl)-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanylethanoate Openeye Name: butyl 2-[6-ethyl-3-(3-methoxyphenyl)-5-methyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl]sulfanylacetate CAS Name: 2-[[6-ethyl-3-(3-methoxyphenyl)-5-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]acetic acid butyl ester IUPAC Name: butyl 2-[6-ethyl-3-(3-methoxyphenyl)-5-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl]sulfanylacetate Traditional Name: 2-[[6-ethyl-4-keto-3-(3-methoxyphenyl)-5-methyl-thieno[2,3-d]pyrimidin-2-yl]thio]acetic acid butyl ester Formula: C22H26N2O4S2 MolecularWeight: 446.58284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CSC1=NC2=C(C(=C(S2)CC)C)C(=O)N1C3=CC(=CC=C3)OC

Isomeric SMILES

CCCCOC(=O)CSC1=NC2=C(C(=C(S2)CC)C)C(=O)N1C3=CC(=CC=C3)OC

InChI

InChI=1S/C22H26N2O4S2/c1-5-7-11-28-18(25)13-29-22-23-20-19(14(3)17(6-2)30-20)21(26)24(22)15-9-8-10-16(12-15)27-4/h8-10,12H,5-7,11,13H2,1-4H3