methyl 4-[[4-[(4-methylphenyl)sulfanylmethyl]phenyl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[4-[(4-methylphenyl)sulfanylmethyl]phenyl]carbonylamino]benzoate Openeye Name: methyl 4-[[4-(p-tolylsulfanylmethyl)benzoyl]amino]benzoate CAS Name: 4-[[[4-[[(4-methylphenyl)thio]methyl]phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[(4-methylphenyl)sulfanylmethyl]benzoyl]amino]benzoate Traditional Name: 4-[[4-[(p-tolylthio)methyl]benzoyl]amino]benzoic acid methyl ester Formula: C23H21NO3S MolecularWeight: 391.48274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C23H21NO3S/c1-16-3-13-21(14-4-16)28-15-17-5-7-18(8-6-17)22(25)24-20-11-9-19(10-12-20)23(26)27-2/h3-14H,15H2,1-2H3,(H,24,25)