3-(5,6-dihydrobenzo[b][1]benzazepin-11-ylcarbamoylamino)benzenesulfonyl fluoride

Systemtic Name: 3-(5,6-dihydrobenzo[b][1]benzazepin-11-ylcarbamoylamino)benzenesulfonyl fluoride Openeye Name: 3-(5,6-dihydrobenzo[b][1]benzazepin-11-ylcarbamoylamino)benzenesulfonyl fluoride CAS Name: 3-[[(5,6-dihydrobenzo[b][1]benzazepin-11-ylamino)-oxomethyl]amino]benzenesulfonyl fluoride IUPAC Name: 3-(5,6-dihydrobenzo[b][1]benzazepin-11-ylcarbamoylamino)benzenesulfonyl fluoride Traditional Name: 3-(5,6-dihydrobenzo[b][1]benzazepin-11-ylcarbamoylamino)benzenesulfonyl fluoride Formula: C21H18FN3O3S MolecularWeight: 411.449323

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C3=CC=CC=C31)NC(=O)NC4=CC(=CC=C4)S(=O)(=O)F

Isomeric SMILES

C1CC2=CC=CC=C2N(C3=CC=CC=C31)NC(=O)NC4=CC(=CC=C4)S(=O)(=O)F

InChI

InChI=1S/C21H18FN3O3S/c22-29(27,28)18-9-5-8-17(14-18)23-21(26)24-25-19-10-3-1-6-15(19)12-13-16-7-2-4-11-20(16)25/h1-11,14H,12-13H2,(H2,23,24,26)