4-ethylsulfanyl-2-phenyl-pyrazole-3-carboxylic acid

Systemtic Name: 4-ethylsulfanyl-2-phenyl-pyrazole-3-carboxylic acid Openeye Name: 4-ethylsulfanyl-2-phenyl-pyrazole-3-carboxylic acid CAS Name: 4-(ethylthio)-2-phenyl-3-pyrazolecarboxylic acid IUPAC Name: 4-ethylsulfanyl-2-phenylpyrazole-3-carboxylic acid Traditional Name: 4-(ethylthio)-2-phenyl-pyrazole-3-carboxylic acid Formula: C12H12N2O2S MolecularWeight: 248.30088

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(N(N=C1)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCSC1=C(N(N=C1)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C12H12N2O2S/c1-2-17-10-8-13-14(11(10)12(15)16)9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H,15,16)