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

Systemtic Name: methyl (2Z)-3-(2-ethoxyethyl)-2-(4-methylphenyl)sulfonylimino-1,3-benzothiazole-6-carboxylate Openeye Name: methyl (2Z)-3-(2-ethoxyethyl)-2-(p-tolylsulfonylimino)-1,3-benzothiazole-6-carboxylate CAS Name: (2Z)-3-(2-ethoxyethyl)-2-(4-methylphenyl)sulfonylimino-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl (2Z)-3-(2-ethoxyethyl)-2-(4-methylphenyl)sulfonylimino-1,3-benzothiazole-6-carboxylate Traditional Name: (2Z)-3-(2-ethoxyethyl)-2-tosylimino-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C20H22N2O5S2 MolecularWeight: 434.52908

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C=C(C=C2)C(=O)OC)SC1=NS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O5S2/c1-4-27-12-11-22-17-10-7-15(19(23)26-3)13-18(17)28-20(22)21-29(24,25)16-8-5-14(2)6-9-16/h5-10,13H,4,11-12H2,1-3H3/b21-20-