ethyl 4-azanyl-2-[(6-chloranyl-3,4-dihydro-2H-chromen-3-yl)carbonyloxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[(6-chloranyl-3,4-dihydro-2H-chromen-3-yl)carbonyloxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-amino-2-[(6-chlorochromane-3-carbonyl)oxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-amino-2-[[(6-chloro-3,4-dihydro-2H-1-benzopyran-3-yl)-oxomethoxy]methyl]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[(6-chloro-3,4-dihydro-2H-chromene-3-carbonyl)oxymethyl]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-amino-2-[(6-chlorochroman-3-carbonyl)oxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C21H20ClN3O5S MolecularWeight: 461.9186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)COC(=O)C3CC4=C(C=CC(=C4)Cl)OC3)N)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)COC(=O)C3CC4=C(C=CC(=C4)Cl)OC3)N)C

InChI

InChI=1S/C21H20ClN3O5S/c1-3-28-21(27)17-10(2)16-18(23)24-15(25-19(16)31-17)9-30-20(26)12-6-11-7-13(22)4-5-14(11)29-8-12/h4-5,7,12H,3,6,8-9H2,1-2H3,(H2,23,24,25)