5-azanyl-3-methylsulfanyl-1-phenyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-azanyl-3-methylsulfanyl-1-phenyl-pyrazole-4-carboxylic acid Openeye Name: 5-amino-3-methylsulfanyl-1-phenyl-pyrazole-4-carboxylic acid CAS Name: 5-amino-3-(methylthio)-1-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 5-amino-3-methylsulfanyl-1-phenylpyrazole-4-carboxylic acid Traditional Name: 5-amino-3-(methylthio)-1-phenyl-pyrazole-4-carboxylic acid Formula: C11H11N3O2S MolecularWeight: 249.28894

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN(C(=C1C(=O)O)N)C2=CC=CC=C2

Isomeric SMILES

CSC1=NN(C(=C1C(=O)O)N)C2=CC=CC=C2

InChI

InChI=1S/C11H11N3O2S/c1-17-10-8(11(15)16)9(12)14(13-10)7-5-3-2-4-6-7/h2-6H,12H2,1H3,(H,15,16)