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

Systemtic Name: N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-2-phenyl-triazole-4-carboxamide CAS Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-2-phenyl-4-triazolecarboxamide IUPAC Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-2-phenyltriazole-4-carboxamide Traditional Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-2-phenyl-triazole-4-carboxamide Formula: C16H9F2N5OS MolecularWeight: 357.337366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2N=CC(=N2)C(=O)NC3=NC4=C(C=C(C=C4S3)F)F

Isomeric SMILES

C1=CC=C(C=C1)N2N=CC(=N2)C(=O)NC3=NC4=C(C=C(C=C4S3)F)F

InChI

InChI=1S/C16H9F2N5OS/c17-9-6-11(18)14-13(7-9)25-16(20-14)21-15(24)12-8-19-23(22-12)10-4-2-1-3-5-10/h1-8H,(H,20,21,24)