tert-butyl 2-[[4-[pentan-2-yl(phenylcarbonyl)amino]phenyl]sulfonylamino]-3-phenyl-propanoate

Systemtic Name: tert-butyl 2-[[4-[pentan-2-yl(phenylcarbonyl)amino]phenyl]sulfonylamino]-3-phenyl-propanoate Openeye Name: tert-butyl 2-[[4-[benzoyl(1-methylbutyl)amino]phenyl]sulfonylamino]-3-phenyl-propanoate CAS Name: 2-[[4-[benzoyl(pentan-2-yl)amino]phenyl]sulfonylamino]-3-phenylpropanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[4-[benzoyl(pentan-2-yl)amino]phenyl]sulfonylamino]-3-phenylpropanoate Traditional Name: 2-[[4-[benzoyl(1-methylbutyl)amino]phenyl]sulfonylamino]-3-phenyl-propionic acid tert-butyl ester Formula: C31H38N2O5S MolecularWeight: 550.70882

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)N(C1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)OC(C)(C)C)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCCC(C)N(C1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)OC(C)(C)C)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C31H38N2O5S/c1-6-13-23(2)33(29(34)25-16-11-8-12-17-25)26-18-20-27(21-19-26)39(36,37)32-28(30(35)38-31(3,4)5)22-24-14-9-7-10-15-24/h7-12,14-21,23,28,32H,6,13,22H2,1-5H3