2-cyclopropyl-4-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-pyrimidine-5-carboxylic acid

Systemtic Name: 2-cyclopropyl-4-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-pyrimidine-5-carboxylic acid Openeye Name: 2-cyclopropyl-4-[2-(cyclopropylamino)-2-oxo-ethyl]sulfanyl-6-methyl-pyrimidine-5-carboxylic acid CAS Name: 2-cyclopropyl-4-[[2-(cyclopropylamino)-2-oxoethyl]thio]-6-methyl-5-pyrimidinecarboxylic acid IUPAC Name: 2-cyclopropyl-4-[2-(cyclopropylamino)-2-oxoethyl]sulfanyl-6-methylpyrimidine-5-carboxylic acid Traditional Name: 2-cyclopropyl-4-[[2-(cyclopropylamino)-2-keto-ethyl]thio]-6-methyl-pyrimidine-5-carboxylic acid Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2CC2)SCC(=O)NC3CC3)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=N1)C2CC2)SCC(=O)NC3CC3)C(=O)O

InChI

InChI=1S/C14H17N3O3S/c1-7-11(14(19)20)13(17-12(15-7)8-2-3-8)21-6-10(18)16-9-4-5-9/h8-9H,2-6H2,1H3,(H,16,18)(H,19,20)