(E)-3-[4-[(6-pyrazol-1-ylpyridin-3-yl)methylsulfamoyl]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-[(6-pyrazol-1-ylpyridin-3-yl)methylsulfamoyl]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[(6-pyrazol-1-yl-3-pyridyl)methylsulfamoyl]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[[6-(1-pyrazolyl)-3-pyridinyl]methylsulfamoyl]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[(6-pyrazol-1-ylpyridin-3-yl)methylsulfamoyl]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[(6-pyrazol-1-yl-3-pyridyl)methylsulfamoyl]phenyl]acrylic acid Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=NC=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)C=CC(=O)O

Isomeric SMILES

C1=CN(N=C1)C2=NC=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)/C=C/C(=O)O

InChI

InChI=1S/C18H16N4O4S/c23-18(24)9-5-14-2-6-16(7-3-14)27(25,26)21-13-15-4-8-17(19-12-15)22-11-1-10-20-22/h1-12,21H,13H2,(H,23,24)/b9-5+