4-[[5-oxidanylidene-1-(phenylmethyl)-4H-pyrazol-3-yl]carbamoyl]benzenesulfonyl fluoride

Systemtic Name: 4-[[5-oxidanylidene-1-(phenylmethyl)-4H-pyrazol-3-yl]carbamoyl]benzenesulfonyl fluoride Openeye Name: 4-[(1-benzyl-5-oxo-4H-pyrazol-3-yl)carbamoyl]benzenesulfonyl fluoride CAS Name: 4-[oxo-[[5-oxo-1-(phenylmethyl)-4H-pyrazol-3-yl]amino]methyl]benzenesulfonyl fluoride IUPAC Name: 4-[(1-benzyl-5-oxo-4H-pyrazol-3-yl)carbamoyl]benzenesulfonyl fluoride Traditional Name: 4-[(1-benzyl-5-keto-2-pyrazolin-3-yl)carbamoyl]benzenesulfonyl fluoride Formula: C17H14FN3O4S MolecularWeight: 375.374163

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NN(C1=O)CC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)F

Isomeric SMILES

C1C(=NN(C1=O)CC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)F

InChI

InChI=1S/C17H14FN3O4S/c18-26(24,25)14-8-6-13(7-9-14)17(23)19-15-10-16(22)21(20-15)11-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,19,20,23)