5-chloranyl-2-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-4-carboxylic acid

Systemtic Name: 5-chloranyl-2-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-4-carboxylic acid Openeye Name: 5-chloro-2-[2-(cyclopropylamino)-2-oxo-ethyl]sulfanyl-pyrimidine-4-carboxylic acid CAS Name: 5-chloro-2-[[2-(cyclopropylamino)-2-oxoethyl]thio]-4-pyrimidinecarboxylic acid IUPAC Name: 5-chloro-2-[2-(cyclopropylamino)-2-oxoethyl]sulfanylpyrimidine-4-carboxylic acid Traditional Name: 5-chloro-2-[[2-(cyclopropylamino)-2-keto-ethyl]thio]pyrimidine-4-carboxylic acid Formula: C10H10ClN3O3S MolecularWeight: 287.7227

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CSC2=NC=C(C(=N2)C(=O)O)Cl

Isomeric SMILES

C1CC1NC(=O)CSC2=NC=C(C(=N2)C(=O)O)Cl

InChI

InChI=1S/C10H10ClN3O3S/c11-6-3-12-10(14-8(6)9(16)17)18-4-7(15)13-5-1-2-5/h3,5H,1-2,4H2,(H,13,15)(H,16,17)