2-[(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methylsulfanyl]ethanoic acid

Systemtic Name: 2-[(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methylsulfanyl]acetic acid CAS Name: 2-[(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methylthio]acetic acid IUPAC Name: 2-[(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methylsulfanyl]acetic acid Traditional Name: 2-[(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methylthio]acetic acid Formula: C15H16N2O2S MolecularWeight: 288.36474

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)N(N=C2CSCC(=O)O)C3=CC=CC=C3

Isomeric SMILES

C1CC2=C(C1)N(N=C2CSCC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C15H16N2O2S/c18-15(19)10-20-9-13-12-7-4-8-14(12)17(16-13)11-5-2-1-3-6-11/h1-3,5-6H,4,7-10H2,(H,18,19)