methyl 4-[[(E)-2-(4-methylphenyl)sulfonyl-2-methylsulfanyl-ethenyl]amino]benzoate

Systemtic Name: methyl 4-[[(E)-2-(4-methylphenyl)sulfonyl-2-methylsulfanyl-ethenyl]amino]benzoate Openeye Name: methyl 4-[[(E)-2-methylsulfanyl-2-(p-tolylsulfonyl)vinyl]amino]benzoate CAS Name: 4-[[(E)-2-(4-methylphenyl)sulfonyl-2-(methylthio)ethenyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(E)-2-(4-methylphenyl)sulfonyl-2-methylsulfanylethenyl]amino]benzoate Traditional Name: 4-[[(E)-2-(methylthio)-2-tosyl-vinyl]amino]benzoic acid methyl ester Formula: C18H19NO4S2 MolecularWeight: 377.47776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CNC2=CC=C(C=C2)C(=O)OC)SC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C(=C/NC2=CC=C(C=C2)C(=O)OC)/SC

InChI

InChI=1S/C18H19NO4S2/c1-13-4-10-16(11-5-13)25(21,22)17(24-3)12-19-15-8-6-14(7-9-15)18(20)23-2/h4-12,19H,1-3H3/b17-12+