methyl 2-cyclopropyl-4-methyl-6-[2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: methyl 2-cyclopropyl-4-methyl-6-[2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: methyl 2-cyclopropyl-4-[2-(1,1-dimethylpropylamino)-2-oxo-ethyl]sulfanyl-6-methyl-pyrimidine-5-carboxylate CAS Name: 2-cyclopropyl-4-methyl-6-[[2-(2-methylbutan-2-ylamino)-2-oxoethyl]thio]-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 2-cyclopropyl-4-methyl-6-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-[[2-(tert-amylamino)-2-keto-ethyl]thio]-2-cyclopropyl-6-methyl-pyrimidine-5-carboxylic acid methyl ester Formula: C17H25N3O3S MolecularWeight: 351.4637

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)CSC1=NC(=NC(=C1C(=O)OC)C)C2CC2

Isomeric SMILES

CCC(C)(C)NC(=O)CSC1=NC(=NC(=C1C(=O)OC)C)C2CC2

InChI

InChI=1S/C17H25N3O3S/c1-6-17(3,4)20-12(21)9-24-15-13(16(22)23-5)10(2)18-14(19-15)11-7-8-11/h11H,6-9H2,1-5H3,(H,20,21)