2-[[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]amino]pyridine-3-carbothioamide

Systemtic Name: 2-[[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]amino]pyridine-3-carbothioamide Openeye Name: 2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]pyridine-3-carbothioamide CAS Name: 2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-3-pyridinecarbothioamide IUPAC Name: 2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]pyridine-3-carbothioamide Traditional Name: 2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]thionicotinamide Formula: C13H9F2N3O2S MolecularWeight: 309.291266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)NC2=CC3=C(C=C2)OC(O3)(F)F)C(=S)N

Isomeric SMILES

C1=CC(=C(N=C1)NC2=CC3=C(C=C2)OC(O3)(F)F)C(=S)N

InChI

InChI=1S/C13H9F2N3O2S/c14-13(15)19-9-4-3-7(6-10(9)20-13)18-12-8(11(16)21)2-1-5-17-12/h1-6H,(H2,16,21)(H,17,18)