methyl 4-methyl-3-[(2-propan-2-ylsulfanylphenyl)carbonylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[(2-propan-2-ylsulfanylphenyl)carbonylamino]benzoate Openeye Name: methyl 3-[(2-isopropylsulfanylbenzoyl)amino]-4-methyl-benzoate CAS Name: 4-methyl-3-[[oxo-[2-(propan-2-ylthio)phenyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[(2-propan-2-ylsulfanylbenzoyl)amino]benzoate Traditional Name: 3-[[2-(isopropylthio)benzoyl]amino]-4-methyl-benzoic acid methyl ester Formula: C19H21NO3S MolecularWeight: 343.43994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CC=CC=C2SC(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CC=CC=C2SC(C)C

InChI

InChI=1S/C19H21NO3S/c1-12(2)24-17-8-6-5-7-15(17)18(21)20-16-11-14(19(22)23-4)10-9-13(16)3/h5-12H,1-4H3,(H,20,21)