ethyl 3-methyl-4-[[4-[(4-methylphenyl)sulfanylmethyl]phenyl]carbonylamino]benzoate

Systemtic Name: ethyl 3-methyl-4-[[4-[(4-methylphenyl)sulfanylmethyl]phenyl]carbonylamino]benzoate Openeye Name: ethyl 3-methyl-4-[[4-(p-tolylsulfanylmethyl)benzoyl]amino]benzoate CAS Name: 3-methyl-4-[[[4-[[(4-methylphenyl)thio]methyl]phenyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-methyl-4-[[4-[(4-methylphenyl)sulfanylmethyl]benzoyl]amino]benzoate Traditional Name: 3-methyl-4-[[4-[(p-tolylthio)methyl]benzoyl]amino]benzoic acid ethyl ester Formula: C25H25NO3S MolecularWeight: 419.5359

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NC(=O)C2=CC=C(C=C2)CSC3=CC=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NC(=O)C2=CC=C(C=C2)CSC3=CC=C(C=C3)C)C

InChI

InChI=1S/C25H25NO3S/c1-4-29-25(28)21-11-14-23(18(3)15-21)26-24(27)20-9-7-19(8-10-20)16-30-22-12-5-17(2)6-13-22/h5-15H,4,16H2,1-3H3,(H,26,27)