methyl 2-[[5-bromanyl-2-[(4-tert-butylphenyl)sulfonylamino]phenyl]carbonylamino]-3-(4-phenylphenyl)propanoate

Systemtic Name: methyl 2-[[5-bromanyl-2-[(4-tert-butylphenyl)sulfonylamino]phenyl]carbonylamino]-3-(4-phenylphenyl)propanoate Openeye Name: methyl 2-[[5-bromo-2-[(4-tert-butylphenyl)sulfonylamino]benzoyl]amino]-3-(4-phenylphenyl)propanoate CAS Name: 2-[[[5-bromo-2-[(4-tert-butylphenyl)sulfonylamino]phenyl]-oxomethyl]amino]-3-(4-phenylphenyl)propanoic acid methyl ester IUPAC Name: methyl 2-[[5-bromo-2-[(4-tert-butylphenyl)sulfonylamino]benzoyl]amino]-3-(4-phenylphenyl)propanoate Traditional Name: 2-[[5-bromo-2-[(4-tert-butylphenyl)sulfonylamino]benzoyl]amino]-3-(4-phenylphenyl)propionic acid methyl ester Formula: C33H33BrN2O5S MolecularWeight: 649.59452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)Br)C(=O)NC(CC3=CC=C(C=C3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)Br)C(=O)NC(CC3=CC=C(C=C3)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C33H33BrN2O5S/c1-33(2,3)25-14-17-27(18-15-25)42(39,40)36-29-19-16-26(34)21-28(29)31(37)35-30(32(38)41-4)20-22-10-12-24(13-11-22)23-8-6-5-7-9-23/h5-19,21,30,36H,20H2,1-4H3,(H,35,37)