4-[2-[ethyl(methyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-2-propan-2-yl-pyrimidine-5-carboxylic acid

Systemtic Name: 4-[2-[ethyl(methyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-2-propan-2-yl-pyrimidine-5-carboxylic acid Openeye Name: 4-[2-[ethyl(methyl)amino]-2-oxo-ethyl]sulfanyl-2-isopropyl-6-methyl-pyrimidine-5-carboxylic acid CAS Name: 4-[[2-[ethyl(methyl)amino]-2-oxoethyl]thio]-6-methyl-2-propan-2-yl-5-pyrimidinecarboxylic acid IUPAC Name: 4-[2-[ethyl(methyl)amino]-2-oxoethyl]sulfanyl-6-methyl-2-propan-2-ylpyrimidine-5-carboxylic acid Traditional Name: 4-[[2-[ethyl(methyl)amino]-2-keto-ethyl]thio]-2-isopropyl-6-methyl-pyrimidine-5-carboxylic acid Formula: C14H21N3O3S MolecularWeight: 311.39984

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C)C(=O)CSC1=NC(=NC(=C1C(=O)O)C)C(C)C

Isomeric SMILES

CCN(C)C(=O)CSC1=NC(=NC(=C1C(=O)O)C)C(C)C

InChI

InChI=1S/C14H21N3O3S/c1-6-17(5)10(18)7-21-13-11(14(19)20)9(4)15-12(16-13)8(2)3/h8H,6-7H2,1-5H3,(H,19,20)