N-(2-methyl-1,3-benzothiazol-6-yl)-4-(trifluoromethylsulfonyl)benzamide

Systemtic Name: N-(2-methyl-1,3-benzothiazol-6-yl)-4-(trifluoromethylsulfonyl)benzamide Openeye Name: N-(2-methyl-1,3-benzothiazol-6-yl)-4-(trifluoromethylsulfonyl)benzamide CAS Name: N-(2-methyl-1,3-benzothiazol-6-yl)-4-(trifluoromethylsulfonyl)benzamide IUPAC Name: N-(2-methyl-1,3-benzothiazol-6-yl)-4-(trifluoromethylsulfonyl)benzamide Traditional Name: N-(2-methyl-1,3-benzothiazol-6-yl)-4-triflyl-benzamide Formula: C16H11F3N2O3S2 MolecularWeight: 400.39535

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)C(F)(F)F

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C16H11F3N2O3S2/c1-9-20-13-7-4-11(8-14(13)25-9)21-15(22)10-2-5-12(6-3-10)26(23,24)16(17,18)19/h2-8H,1H3,(H,21,22)