1-phenyl-N-[6-(trifluoromethyloxy)-1,3-benzothiazol-2-yl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-phenyl-N-[6-(trifluoromethyloxy)-1,3-benzothiazol-2-yl]-1,2,3-triazole-4-carboxamide Openeye Name: 1-phenyl-N-[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]triazole-4-carboxamide CAS Name: 1-phenyl-N-[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]-4-triazolecarboxamide IUPAC Name: 1-phenyl-N-[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]triazole-4-carboxamide Traditional Name: 1-phenyl-N-[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]triazole-4-carboxamide Formula: C17H10F3N5O2S MolecularWeight: 405.35381

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(N=N2)C(=O)NC3=NC4=C(S3)C=C(C=C4)OC(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(N=N2)C(=O)NC3=NC4=C(S3)C=C(C=C4)OC(F)(F)F

InChI

InChI=1S/C17H10F3N5O2S/c18-17(19,20)27-11-6-7-12-14(8-11)28-16(21-12)22-15(26)13-9-25(24-23-13)10-4-2-1-3-5-10/h1-9H,(H,21,22,26)