1-phenyl-3-[[[3-(phenylsulfonylmethyl)furan-2-yl]carbonylamino]carbamoyl]pyrazol-4-olate

Systemtic Name: 1-phenyl-3-[[[3-(phenylsulfonylmethyl)furan-2-yl]carbonylamino]carbamoyl]pyrazol-4-olate Openeye Name: 3-[[[3-(benzenesulfonylmethyl)furan-2-carbonyl]amino]carbamoyl]-1-phenyl-pyrazol-4-olate CAS Name: 3-[[[[3-(benzenesulfonylmethyl)-2-furanyl]-oxomethyl]hydrazo]-oxomethyl]-1-phenyl-4-pyrazololate IUPAC Name: 3-[[[3-(benzenesulfonylmethyl)furan-2-carbonyl]amino]carbamoyl]-1-phenylpyrazol-4-olate Traditional Name: 3-[[[3-(besylmethyl)-2-furoyl]amino]carbamoyl]-1-phenyl-pyrazol-4-olate Formula: C22H17N4O6S- MolecularWeight: 465.45858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C(=O)NNC(=O)C3=C(C=CO3)CS(=O)(=O)C4=CC=CC=C4)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C(=O)NNC(=O)C3=C(C=CO3)CS(=O)(=O)C4=CC=CC=C4)[O-]

InChI

InChI=1S/C22H18N4O6S/c27-18-13-26(16-7-3-1-4-8-16)25-19(18)21(28)23-24-22(29)20-15(11-12-32-20)14-33(30,31)17-9-5-2-6-10-17/h1-13,27H,14H2,(H,23,28)(H,24,29)/p-1