ethyl 5-methyl-4-(2-pyrrolidin-1-ylethylsulfanyl)thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-4-(2-pyrrolidin-1-ylethylsulfanyl)thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-4-(2-pyrrolidin-1-ylethylsulfanyl)thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-[2-(1-pyrrolidinyl)ethylthio]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-(2-pyrrolidin-1-ylethylsulfanyl)thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-methyl-4-(2-pyrrolidinoethylthio)thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C16H21N3O2S2 MolecularWeight: 351.48684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=CN=C2SCCN3CCCC3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=CN=C2SCCN3CCCC3)C

InChI

InChI=1S/C16H21N3O2S2/c1-3-21-16(20)13-11(2)12-14(17-10-18-15(12)23-13)22-9-8-19-6-4-5-7-19/h10H,3-9H2,1-2H3