methyl 2-[(2Z)-2-(4-methoxyphenyl)sulfonylimino-5,7-dimethyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[(2Z)-2-(4-methoxyphenyl)sulfonylimino-5,7-dimethyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[(2Z)-2-(4-methoxyphenyl)sulfonylimino-5,7-dimethyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[(2Z)-2-(4-methoxyphenyl)sulfonylimino-5,7-dimethyl-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[(2Z)-2-(4-methoxyphenyl)sulfonylimino-5,7-dimethyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[(2Z)-2-(4-methoxyphenyl)sulfonylimino-5,7-dimethyl-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C19H20N2O5S2 MolecularWeight: 420.5025

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N(C(=NS(=O)(=O)C3=CC=C(C=C3)OC)S2)CC(=O)OC)C

Isomeric SMILES

CC1=CC(=C2C(=C1)N(/C(=N/S(=O)(=O)C3=CC=C(C=C3)OC)/S2)CC(=O)OC)C

InChI

InChI=1S/C19H20N2O5S2/c1-12-9-13(2)18-16(10-12)21(11-17(22)26-4)19(27-18)20-28(23,24)15-7-5-14(25-3)6-8-15/h5-10H,11H2,1-4H3/b20-19-