ethyl 2-methylsulfanyl-4-(3-oxidanylpropylamino)pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-methylsulfanyl-4-(3-oxidanylpropylamino)pyrimidine-5-carboxylate Openeye Name: ethyl 4-(3-hydroxypropylamino)-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-(3-hydroxypropylamino)-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-hydroxypropylamino)-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-(3-hydroxypropylamino)-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C11H17N3O3S MolecularWeight: 271.33598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NCCCO)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NCCCO)SC

InChI

InChI=1S/C11H17N3O3S/c1-3-17-10(16)8-7-13-11(18-2)14-9(8)12-5-4-6-15/h7,15H,3-6H2,1-2H3,(H,12,13,14)