4-(1H-indazol-5-ylamino)-2-methylsulfanyl-pyrimidine-5-carboxylic acid

Systemtic Name: 4-(1H-indazol-5-ylamino)-2-methylsulfanyl-pyrimidine-5-carboxylic acid Openeye Name: 4-(1H-indazol-5-ylamino)-2-methylsulfanyl-pyrimidine-5-carboxylic acid CAS Name: 4-(1H-indazol-5-ylamino)-2-(methylthio)-5-pyrimidinecarboxylic acid IUPAC Name: 4-(1H-indazol-5-ylamino)-2-methylsulfanylpyrimidine-5-carboxylic acid Traditional Name: 4-(1H-indazol-5-ylamino)-2-(methylthio)pyrimidine-5-carboxylic acid Formula: C13H11N5O2S MolecularWeight: 301.32374

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)NC2=CC3=C(C=C2)NN=C3)C(=O)O

Isomeric SMILES

CSC1=NC=C(C(=N1)NC2=CC3=C(C=C2)NN=C3)C(=O)O

InChI

InChI=1S/C13H11N5O2S/c1-21-13-14-6-9(12(19)20)11(17-13)16-8-2-3-10-7(4-8)5-15-18-10/h2-6H,1H3,(H,15,18)(H,19,20)(H,14,16,17)