(2Z)-3-(2-ethoxyethyl)-2-(4-methylphenyl)sulfonylimino-1,3-benzothiazole-6-sulfonamide

Systemtic Name: (2Z)-3-(2-ethoxyethyl)-2-(4-methylphenyl)sulfonylimino-1,3-benzothiazole-6-sulfonamide Openeye Name: (2Z)-3-(2-ethoxyethyl)-2-(p-tolylsulfonylimino)-1,3-benzothiazole-6-sulfonamide CAS Name: (2Z)-3-(2-ethoxyethyl)-2-(4-methylphenyl)sulfonylimino-1,3-benzothiazole-6-sulfonamide IUPAC Name: (2Z)-3-(2-ethoxyethyl)-2-(4-methylphenyl)sulfonylimino-1,3-benzothiazole-6-sulfonamide Traditional Name: (2Z)-3-(2-ethoxyethyl)-2-tosylimino-1,3-benzothiazole-6-sulfonamide Formula: C18H21N3O5S3 MolecularWeight: 455.57144

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C=C(C=C2)S(=O)(=O)N)SC1=NS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOCCN\1C2=C(C=C(C=C2)S(=O)(=O)N)S/C1=N\S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C18H21N3O5S3/c1-3-26-11-10-21-16-9-8-15(28(19,22)23)12-17(16)27-18(21)20-29(24,25)14-6-4-13(2)5-7-14/h4-9,12H,3,10-11H2,1-2H3,(H2,19,22,23)/b20-18-