methyl 2-[(2Z)-2-(4-chlorophenyl)sulfonylimino-5,6-dimethyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[(2Z)-2-(4-chlorophenyl)sulfonylimino-5,6-dimethyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[(2Z)-2-(4-chlorophenyl)sulfonylimino-5,6-dimethyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[(2Z)-2-(4-chlorophenyl)sulfonylimino-5,6-dimethyl-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[(2Z)-2-(4-chlorophenyl)sulfonylimino-5,6-dimethyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[(2Z)-2-(4-chlorophenyl)sulfonylimino-5,6-dimethyl-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C18H17ClN2O4S2 MolecularWeight: 424.92158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=NS(=O)(=O)C3=CC=C(C=C3)Cl)N2CC(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1C)S/C(=N\S(=O)(=O)C3=CC=C(C=C3)Cl)/N2CC(=O)OC

InChI

InChI=1S/C18H17ClN2O4S2/c1-11-8-15-16(9-12(11)2)26-18(21(15)10-17(22)25-3)20-27(23,24)14-6-4-13(19)5-7-14/h4-9H,10H2,1-3H3/b20-18-