N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-[(4-fluorophenyl)sulfonylamino]benzamide

Systemtic Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-[(4-fluorophenyl)sulfonylamino]benzamide Openeye Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-[(4-fluorophenyl)sulfonylamino]benzamide CAS Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-[(4-fluorophenyl)sulfonylamino]benzamide IUPAC Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-[(4-fluorophenyl)sulfonylamino]benzamide Traditional Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-[(4-fluorophenyl)sulfonylamino]benzamide Formula: C22H18FN3O3S2 MolecularWeight: 455.525023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)NC(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)NC(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H18FN3O3S2/c1-13-10-19-20(11-14(13)2)30-22(24-19)25-21(27)15-4-3-5-17(12-15)26-31(28,29)18-8-6-16(23)7-9-18/h3-12,26H,1-2H3,(H,24,25,27)