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

Systemtic Name: ethyl 5-azanyl-4-(butylamino)-2-methylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-amino-4-(butylamino)-2-methylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-amino-4-(butylamino)-2-(methylthio)-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-(butylamino)-2-methylsulfanylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-amino-4-(butylamino)-2-(methylthio)thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C14H20N4O2S2 MolecularWeight: 340.4642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C2C(=C(SC2=NC(=N1)SC)C(=O)OCC)N

Isomeric SMILES

CCCCNC1=C2C(=C(SC2=NC(=N1)SC)C(=O)OCC)N

InChI

InChI=1S/C14H20N4O2S2/c1-4-6-7-16-11-8-9(15)10(13(19)20-5-2)22-12(8)18-14(17-11)21-3/h4-7,15H2,1-3H3,(H,16,17,18)