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

Systemtic Name: ethyl 5-methyl-4-(octylamino)thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-4-(octylamino)thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-(octylamino)-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-(octylamino)thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-methyl-4-(octylamino)thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C18H27N3O2S MolecularWeight: 349.49088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=C2C(=C(SC2=NC=N1)C(=O)OCC)C

Isomeric SMILES

CCCCCCCCNC1=C2C(=C(SC2=NC=N1)C(=O)OCC)C

InChI

InChI=1S/C18H27N3O2S/c1-4-6-7-8-9-10-11-19-16-14-13(3)15(18(22)23-5-2)24-17(14)21-12-20-16/h12H,4-11H2,1-3H3,(H,19,20,21)