2-[(2-oxidanylidene-1,3-benzoxathiol-6-yl)oxymethyl]benzenecarbothioamide

Systemtic Name: 2-[(2-oxidanylidene-1,3-benzoxathiol-6-yl)oxymethyl]benzenecarbothioamide Openeye Name: 2-[(2-oxo-1,3-benzoxathiol-6-yl)oxymethyl]benzenecarbothioamide CAS Name: 2-[(2-oxo-1,3-benzoxathiol-6-yl)oxymethyl]benzenecarbothioamide IUPAC Name: 2-[(2-oxo-1,3-benzoxathiol-6-yl)oxymethyl]benzenecarbothioamide Traditional Name: 2-[(2-keto-1,3-benzoxathiol-6-yl)oxymethyl]thiobenzamide Formula: C15H11NO3S2 MolecularWeight: 317.38274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC2=CC3=C(C=C2)SC(=O)O3)C(=S)N

Isomeric SMILES

C1=CC=C(C(=C1)COC2=CC3=C(C=C2)SC(=O)O3)C(=S)N

InChI

InChI=1S/C15H11NO3S2/c16-14(20)11-4-2-1-3-9(11)8-18-10-5-6-13-12(7-10)19-15(17)21-13/h1-7H,8H2,(H2,16,20)