[(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 4-[methyl-(4-methylphenyl)sulfonyl-amino]benzoate

Systemtic Name: [(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 4-[methyl-(4-methylphenyl)sulfonyl-amino]benzoate Openeye Name: [(1R)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl] 4-[methyl(p-tolylsulfonyl)amino]benzoate CAS Name: 4-[methyl-(4-methylphenyl)sulfonylamino]benzoic acid [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] 4-[methyl-(4-methylphenyl)sulfonylamino]benzoate Traditional Name: 4-[methyl(tosyl)amino]benzoic acid [(1R)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H24N2O5S MolecularWeight: 416.49066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)OC(C)C(=O)NC3CC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)O[C@H](C)C(=O)NC3CC3

InChI

InChI=1S/C21H24N2O5S/c1-14-4-12-19(13-5-14)29(26,27)23(3)18-10-6-16(7-11-18)21(25)28-15(2)20(24)22-17-8-9-17/h4-7,10-13,15,17H,8-9H2,1-3H3,(H,22,24)/t15-/m1/s1