[2,4-bis(chloranyl)-6-[(3-methylsulfanylphenyl)iminomethyl]phenyl] 4-methylbenzenesulfonate

Systemtic Name: [2,4-bis(chloranyl)-6-[(3-methylsulfanylphenyl)iminomethyl]phenyl] 4-methylbenzenesulfonate Openeye Name: [2,4-dichloro-6-[(3-methylsulfanylphenyl)iminomethyl]phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2,4-dichloro-6-[[3-(methylthio)phenyl]iminomethyl]phenyl] ester IUPAC Name: [2,4-dichloro-6-[(3-methylsulfanylphenyl)iminomethyl]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2,4-dichloro-6-[[3-(methylthio)phenyl]iminomethyl]phenyl] ester Formula: C21H17Cl2NO3S2 MolecularWeight: 466.40058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2C=NC3=CC(=CC=C3)SC)Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2C=NC3=CC(=CC=C3)SC)Cl)Cl

InChI

InChI=1S/C21H17Cl2NO3S2/c1-14-6-8-19(9-7-14)29(25,26)27-21-15(10-16(22)11-20(21)23)13-24-17-4-3-5-18(12-17)28-2/h3-13H,1-2H3