4-[2-[cyclopropyl(ethyl)amino]-2-oxidanylidene-ethyl]sulfanyl-2,6-dimethyl-pyrimidine-5-carboxylic acid

Systemtic Name: 4-[2-[cyclopropyl(ethyl)amino]-2-oxidanylidene-ethyl]sulfanyl-2,6-dimethyl-pyrimidine-5-carboxylic acid Openeye Name: 4-[2-[cyclopropyl(ethyl)amino]-2-oxo-ethyl]sulfanyl-2,6-dimethyl-pyrimidine-5-carboxylic acid CAS Name: 4-[[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]thio]-2,6-dimethyl-5-pyrimidinecarboxylic acid IUPAC Name: 4-[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]sulfanyl-2,6-dimethylpyrimidine-5-carboxylic acid Traditional Name: 4-[[2-[cyclopropyl(ethyl)amino]-2-keto-ethyl]thio]-2,6-dimethyl-pyrimidine-5-carboxylic acid Formula: C14H19N3O3S MolecularWeight: 309.38396

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CC1)C(=O)CSC2=NC(=NC(=C2C(=O)O)C)C

Isomeric SMILES

CCN(C1CC1)C(=O)CSC2=NC(=NC(=C2C(=O)O)C)C

InChI

InChI=1S/C14H19N3O3S/c1-4-17(10-5-6-10)11(18)7-21-13-12(14(19)20)8(2)15-9(3)16-13/h10H,4-7H2,1-3H3,(H,19,20)