ethyl 2-[3-(1H-indol-3-yl)propanoyloxymethyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 2-[3-(1H-indol-3-yl)propanoyloxymethyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2-[3-(1H-indol-3-yl)propanoyloxymethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[[3-(1H-indol-3-yl)-1-oxopropoxy]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(1H-indol-3-yl)propanoyloxymethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[3-(1H-indol-3-yl)propanoyloxymethyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C22H21N3O5S MolecularWeight: 439.48424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)COC(=O)CCC3=CNC4=CC=CC=C43)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)COC(=O)CCC3=CNC4=CC=CC=C43)C

InChI

InChI=1S/C22H21N3O5S/c1-3-29-22(28)19-12(2)18-20(27)24-16(25-21(18)31-19)11-30-17(26)9-8-13-10-23-15-7-5-4-6-14(13)15/h4-7,10,23H,3,8-9,11H2,1-2H3,(H,24,25,27)