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

Systemtic Name: 2-[[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]amino]benzenecarbothioamide Openeye Name: 2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]benzenecarbothioamide CAS Name: 2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]benzenecarbothioamide IUPAC Name: 2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]benzenecarbothioamide Traditional Name: 2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]thiobenzamide Formula: C14H10F2N2O2S MolecularWeight: 308.303206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10F2N2O2S/c15-14(16)19-11-6-5-8(7-12(11)20-14)18-10-4-2-1-3-9(10)13(17)21/h1-7,18H,(H2,17,21)