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

Systemtic Name: methyl 2-[(2Z)-6-bromanyl-2-(4-chlorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[(2Z)-6-bromo-2-(4-chlorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[(2Z)-6-bromo-2-(4-chlorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[(2Z)-6-bromo-2-(4-chlorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[(2Z)-6-bromo-2-(4-chlorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C16H12BrClN2O4S2 MolecularWeight: 475.76448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=C(C=C(C=C2)Br)SC1=NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)CN\1C2=C(C=C(C=C2)Br)S/C1=N\S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H12BrClN2O4S2/c1-24-15(21)9-20-13-7-2-10(17)8-14(13)25-16(20)19-26(22,23)12-5-3-11(18)4-6-12/h2-8H,9H2,1H3/b19-16-