ethyl 2-methylsulfanyl-4-(propan-2-ylamino)pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-methylsulfanyl-4-(propan-2-ylamino)pyrimidine-5-carboxylate Openeye Name: ethyl 4-(isopropylamino)-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 2-(methylthio)-4-(propan-2-ylamino)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methylsulfanyl-4-(propan-2-ylamino)pyrimidine-5-carboxylate Traditional Name: 4-(isopropylamino)-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C11H17N3O2S MolecularWeight: 255.33658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NC(C)C)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NC(C)C)SC

InChI

InChI=1S/C11H17N3O2S/c1-5-16-10(15)8-6-12-11(17-4)14-9(8)13-7(2)3/h6-7H,5H2,1-4H3,(H,12,13,14)