methyl 2-[[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenyl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenyl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[[4-[methyl(p-tolylsulfonyl)amino]benzoyl]amino]-3-phenyl-propanoate CAS Name: 2-[[[4-[methyl-(4-methylphenyl)sulfonylamino]phenyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[4-[methyl-(4-methylphenyl)sulfonylamino]benzoyl]amino]-3-phenylpropanoate Traditional Name: 2-[[4-[methyl(tosyl)amino]benzoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C25H26N2O5S MolecularWeight: 466.54934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C25H26N2O5S/c1-18-9-15-22(16-10-18)33(30,31)27(2)21-13-11-20(12-14-21)24(28)26-23(25(29)32-3)17-19-7-5-4-6-8-19/h4-16,23H,17H2,1-3H3,(H,26,28)