N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-fluorophenyl)sulfonylamino]benzamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-fluorophenyl)sulfonylamino]benzamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-fluorophenyl)sulfonylamino]benzamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-fluorophenyl)sulfonylamino]benzamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-fluorophenyl)sulfonylamino]benzamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-fluorophenyl)sulfonylamino]benzamide Formula: C21H16FN3O3S2 MolecularWeight: 441.498443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCC2=NC3=CC=CC=C3S2)NS(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCC2=NC3=CC=CC=C3S2)NS(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H16FN3O3S2/c22-14-9-11-15(12-10-14)30(27,28)25-17-6-2-1-5-16(17)21(26)23-13-20-24-18-7-3-4-8-19(18)29-20/h1-12,25H,13H2,(H,23,26)