N-[2-oxidanylidene-2-[[4-(trifluoromethyloxy)phenyl]amino]ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[2-oxidanylidene-2-[[4-(trifluoromethyloxy)phenyl]amino]ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Openeye Name: N-[2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide CAS Name: N-[2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl]-2-(1-pyrrolyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Traditional Name: N-[2-keto-2-[4-(trifluoromethoxy)anilino]ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Formula: C21H15F3N4O3S MolecularWeight: 460.42901

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=NC3=C(S2)C=C(C=C3)C(=O)NCC(=O)NC4=CC=C(C=C4)OC(F)(F)F

Isomeric SMILES

C1=CN(C=C1)C2=NC3=C(S2)C=C(C=C3)C(=O)NCC(=O)NC4=CC=C(C=C4)OC(F)(F)F

InChI

InChI=1S/C21H15F3N4O3S/c22-21(23,24)31-15-6-4-14(5-7-15)26-18(29)12-25-19(30)13-3-8-16-17(11-13)32-20(27-16)28-9-1-2-10-28/h1-11H,12H2,(H,25,30)(H,26,29)