3-(2-oxidanylidene-1,3-benzothiazol-3-yl)propoxymethanedithioic acid

Systemtic Name: 3-(2-oxidanylidene-1,3-benzothiazol-3-yl)propoxymethanedithioic acid Openeye Name: 3-(2-oxo-1,3-benzothiazol-3-yl)propoxymethanedithioic acid CAS Name: 3-(2-oxo-1,3-benzothiazol-3-yl)propoxymethanedithioic acid IUPAC Name: 3-(2-oxo-1,3-benzothiazol-3-yl)propoxymethanedithioic acid Traditional Name: 3-(2-keto-1,3-benzothiazol-3-yl)propoxymethanedithioic acid Formula: C11H11NO2S3 MolecularWeight: 285.40554

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=O)S2)CCCOC(=S)S

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=O)S2)CCCOC(=S)S

InChI

InChI=1S/C11H11NO2S3/c13-10-12(6-3-7-14-11(15)16)8-4-1-2-5-9(8)17-10/h1-2,4-5H,3,6-7H2,(H,15,16)