4-(2,1,3-benzoxadiazol-5-ylmethoxy)benzenecarbothioamide

Systemtic Name: 4-(2,1,3-benzoxadiazol-5-ylmethoxy)benzenecarbothioamide Openeye Name: 4-(2,1,3-benzoxadiazol-5-ylmethoxy)benzenecarbothioamide CAS Name: 4-(2,1,3-benzoxadiazol-5-ylmethoxy)benzenecarbothioamide IUPAC Name: 4-(2,1,3-benzoxadiazol-5-ylmethoxy)benzenecarbothioamide Traditional Name: 4-(benzofurazan-5-ylmethoxy)thiobenzamide Formula: C14H11N3O2S MolecularWeight: 285.32104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=S)N)OCC2=CC3=NON=C3C=C2

Isomeric SMILES

C1=CC(=CC=C1C(=S)N)OCC2=CC3=NON=C3C=C2

InChI

InChI=1S/C14H11N3O2S/c15-14(20)10-2-4-11(5-3-10)18-8-9-1-6-12-13(7-9)17-19-16-12/h1-7H,8H2,(H2,15,20)