ethyl (2R,3S)-3-[(4-methoxyphenyl)amino]-2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanoate

Systemtic Name: ethyl (2R,3S)-3-[(4-methoxyphenyl)amino]-2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanoate Openeye Name: ethyl (2R,3S)-3-(4-methoxyanilino)-3-phenyl-2-(p-tolylsulfonylamino)propanoate CAS Name: (2R,3S)-3-(4-methoxyanilino)-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl (2R,3S)-3-(4-methoxyanilino)-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoate Traditional Name: (2R,3S)-3-(p-anisidino)-3-phenyl-2-(tosylamino)propionic acid ethyl ester Formula: C25H28N2O5S MolecularWeight: 468.56522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=CC=C1)NC2=CC=C(C=C2)OC)NS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)[C@@H]([C@H](C1=CC=CC=C1)NC2=CC=C(C=C2)OC)NS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C25H28N2O5S/c1-4-32-25(28)24(27-33(29,30)22-16-10-18(2)11-17-22)23(19-8-6-5-7-9-19)26-20-12-14-21(31-3)15-13-20/h5-17,23-24,26-27H,4H2,1-3H3/t23-,24+/m0/s1