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

Systemtic Name: methyl (2Z)-2-(4-methylphenyl)sulfonylimino-3-prop-2-enyl-1,3-benzothiazole-6-carboxylate Openeye Name: methyl (2Z)-3-allyl-2-(p-tolylsulfonylimino)-1,3-benzothiazole-6-carboxylate CAS Name: (2Z)-2-(4-methylphenyl)sulfonylimino-3-prop-2-enyl-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl (2Z)-2-(4-methylphenyl)sulfonylimino-3-prop-2-enyl-1,3-benzothiazole-6-carboxylate Traditional Name: (2Z)-3-allyl-2-tosylimino-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C19H18N2O4S2 MolecularWeight: 402.48722

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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)C(=O)OC)CC=C

Isomeric SMILES

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

InChI

InChI=1S/C19H18N2O4S2/c1-4-11-21-16-10-7-14(18(22)25-3)12-17(16)26-19(21)20-27(23,24)15-8-5-13(2)6-9-15/h4-10,12H,1,11H2,2-3H3/b20-19-