tert-butyl 2-[[4-[(4-methylphenyl)carbonylamino]phenyl]sulfonylamino]-3-phenyl-propanoate

Systemtic Name: tert-butyl 2-[[4-[(4-methylphenyl)carbonylamino]phenyl]sulfonylamino]-3-phenyl-propanoate Openeye Name: tert-butyl 2-[[4-[(4-methylbenzoyl)amino]phenyl]sulfonylamino]-3-phenyl-propanoate CAS Name: 2-[[4-[[(4-methylphenyl)-oxomethyl]amino]phenyl]sulfonylamino]-3-phenylpropanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[4-[(4-methylbenzoyl)amino]phenyl]sulfonylamino]-3-phenylpropanoate Traditional Name: 3-phenyl-2-[[4-(p-toluoylamino)phenyl]sulfonylamino]propionic acid tert-butyl ester Formula: C27H30N2O5S MolecularWeight: 494.6025

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC(CC3=CC=CC=C3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC(CC3=CC=CC=C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C27H30N2O5S/c1-19-10-12-21(13-11-19)25(30)28-22-14-16-23(17-15-22)35(32,33)29-24(26(31)34-27(2,3)4)18-20-8-6-5-7-9-20/h5-17,24,29H,18H2,1-4H3,(H,28,30)