ethyl 3-methyl-7-methylsulfanyl-5-pyrrolidin-1-yl-[1,2,4]triazolo[4,3-c]pyrimidine-8-carboxylate

Systemtic Name: ethyl 3-methyl-7-methylsulfanyl-5-pyrrolidin-1-yl-[1,2,4]triazolo[4,3-c]pyrimidine-8-carboxylate Openeye Name: ethyl 3-methyl-7-methylsulfanyl-5-pyrrolidin-1-yl-[1,2,4]triazolo[4,3-c]pyrimidine-8-carboxylate CAS Name: 3-methyl-7-(methylthio)-5-(1-pyrrolidinyl)-[1,2,4]triazolo[4,3-c]pyrimidine-8-carboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-7-methylsulfanyl-5-pyrrolidin-1-yl-[1,2,4]triazolo[4,3-c]pyrimidine-8-carboxylate Traditional Name: 3-methyl-7-(methylthio)-5-pyrrolidino-[1,2,4]triazolo[4,3-c]pyrimidine-8-carboxylic acid ethyl ester Formula: C14H19N5O2S MolecularWeight: 321.39796

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N2C1=NN=C2C)N3CCCC3)SC

Isomeric SMILES

CCOC(=O)C1=C(N=C(N2C1=NN=C2C)N3CCCC3)SC

InChI

InChI=1S/C14H19N5O2S/c1-4-21-13(20)10-11-17-16-9(2)19(11)14(15-12(10)22-3)18-7-5-6-8-18/h4-8H2,1-3H3