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

Systemtic Name: (2Z)-3-(2-methoxyethyl)-2-(4-methylphenyl)sulfonylimino-1,3-benzothiazole-6-sulfonamide Openeye Name: (2Z)-3-(2-methoxyethyl)-2-(p-tolylsulfonylimino)-1,3-benzothiazole-6-sulfonamide CAS Name: (2Z)-3-(2-methoxyethyl)-2-(4-methylphenyl)sulfonylimino-1,3-benzothiazole-6-sulfonamide IUPAC Name: (2Z)-3-(2-methoxyethyl)-2-(4-methylphenyl)sulfonylimino-1,3-benzothiazole-6-sulfonamide Traditional Name: (2Z)-3-(2-methoxyethyl)-2-tosylimino-1,3-benzothiazole-6-sulfonamide Formula: C17H19N3O5S3 MolecularWeight: 441.54486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=C2N(C3=C(S2)C=C(C=C3)S(=O)(=O)N)CCOC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/N=C\2/N(C3=C(S2)C=C(C=C3)S(=O)(=O)N)CCOC

InChI

InChI=1S/C17H19N3O5S3/c1-12-3-5-13(6-4-12)28(23,24)19-17-20(9-10-25-2)15-8-7-14(27(18,21)22)11-16(15)26-17/h3-8,11H,9-10H2,1-2H3,(H2,18,21,22)/b19-17-