ethyl 4-[3-(2-acetyloxyethoxy)phenyl]-5-azanyl-2-methylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-[3-(2-acetyloxyethoxy)phenyl]-5-azanyl-2-methylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-[3-(2-acetoxyethoxy)phenyl]-5-amino-2-methylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-[3-(2-acetyloxyethoxy)phenyl]-5-amino-2-(methylthio)-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(2-acetyloxyethoxy)phenyl]-5-amino-2-methylsulfanylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-[3-(2-acetoxyethoxy)phenyl]-5-amino-2-(methylthio)thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C20H21N3O5S2 MolecularWeight: 447.52784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)SC)C3=CC(=CC=C3)OCCOC(=O)C)N

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)SC)C3=CC(=CC=C3)OCCOC(=O)C)N

InChI

InChI=1S/C20H21N3O5S2/c1-4-26-19(25)17-15(21)14-16(22-20(29-3)23-18(14)30-17)12-6-5-7-13(10-12)28-9-8-27-11(2)24/h5-7,10H,4,8-9,21H2,1-3H3