2-[5-[(4-chlorophenyl)sulfonylcarbamoylamino]-4-cyano-1-phenyl-pyrazol-3-yl]ethanoic acid

Systemtic Name: 2-[5-[(4-chlorophenyl)sulfonylcarbamoylamino]-4-cyano-1-phenyl-pyrazol-3-yl]ethanoic acid Openeye Name: 2-[5-[(4-chlorophenyl)sulfonylcarbamoylamino]-4-cyano-1-phenyl-pyrazol-3-yl]acetic acid CAS Name: 2-[5-[[[(4-chlorophenyl)sulfonylamino]-oxomethyl]amino]-4-cyano-1-phenyl-3-pyrazolyl]acetic acid IUPAC Name: 2-[5-[(4-chlorophenyl)sulfonylcarbamoylamino]-4-cyano-1-phenylpyrazol-3-yl]acetic acid Traditional Name: 2-[5-[(4-chlorophenyl)sulfonylcarbamoylamino]-4-cyano-1-phenyl-pyrazol-3-yl]acetic acid Formula: C19H14ClN5O5S MolecularWeight: 459.86296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C(=N2)CC(=O)O)C#N)NC(=O)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C(=N2)CC(=O)O)C#N)NC(=O)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H14ClN5O5S/c20-12-6-8-14(9-7-12)31(29,30)24-19(28)22-18-15(11-21)16(10-17(26)27)23-25(18)13-4-2-1-3-5-13/h1-9H,10H2,(H,26,27)(H2,22,24,28)