azanyl 2-(2-sulfanylidene-1,3-benzothiazol-3-yl)ethanesulfonate

Systemtic Name: azanyl 2-(2-sulfanylidene-1,3-benzothiazol-3-yl)ethanesulfonate Openeye Name: amino 2-(2-thioxo-1,3-benzothiazol-3-yl)ethanesulfonate CAS Name: 2-(2-sulfanylidene-1,3-benzothiazol-3-yl)ethanesulfonic acid amino ester IUPAC Name: amino 2-(2-sulfanylidene-1,3-benzothiazol-3-yl)ethanesulfonate Traditional Name: 2-(2-thioxo-1,3-benzothiazol-3-yl)ethanesulfonic acid amino ester Formula: C9H10N2O3S3 MolecularWeight: 290.3823

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=S)S2)CCS(=O)(=O)ON

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=S)S2)CCS(=O)(=O)ON

InChI

InChI=1S/C9H10N2O3S3/c10-14-17(12,13)6-5-11-7-3-1-2-4-8(7)16-9(11)15/h1-4H,5-6,10H2