2-cyclopropyl-4-[1-(ethylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-6-methyl-pyrimidine-5-carboxylic acid

Systemtic Name: 2-cyclopropyl-4-[1-(ethylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-6-methyl-pyrimidine-5-carboxylic acid Openeye Name: 2-cyclopropyl-4-[2-(ethylamino)-1-methyl-2-oxo-ethyl]sulfanyl-6-methyl-pyrimidine-5-carboxylic acid CAS Name: 2-cyclopropyl-4-[[1-(ethylamino)-1-oxopropan-2-yl]thio]-6-methyl-5-pyrimidinecarboxylic acid IUPAC Name: 2-cyclopropyl-4-[1-(ethylamino)-1-oxopropan-2-yl]sulfanyl-6-methylpyrimidine-5-carboxylic acid Traditional Name: 2-cyclopropyl-4-[[2-(ethylamino)-2-keto-1-methyl-ethyl]thio]-6-methyl-pyrimidine-5-carboxylic acid Formula: C14H19N3O3S MolecularWeight: 309.38396

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)SC1=NC(=NC(=C1C(=O)O)C)C2CC2

Isomeric SMILES

CCNC(=O)C(C)SC1=NC(=NC(=C1C(=O)O)C)C2CC2

InChI

InChI=1S/C14H19N3O3S/c1-4-15-12(18)8(3)21-13-10(14(19)20)7(2)16-11(17-13)9-5-6-9/h8-9H,4-6H2,1-3H3,(H,15,18)(H,19,20)