1-tert-butyl-3-[(3S)-7-methyl-3-oxidanyl-1-phenyl-octan-4-yl]-1-[(2-methyl-3-phenethylsulfonyl-propanoyl)amino]urea

Systemtic Name: 1-tert-butyl-3-[(3S)-7-methyl-3-oxidanyl-1-phenyl-octan-4-yl]-1-[(2-methyl-3-phenethylsulfonyl-propanoyl)amino]urea Openeye Name: 1-tert-butyl-3-[1-[(1S)-1-hydroxy-3-phenyl-propyl]-4-methyl-pentyl]-1-[(2-methyl-3-phenethylsulfonyl-propanoyl)amino]urea CAS Name: 1-tert-butyl-3-[(3S)-3-hydroxy-7-methyl-1-phenyloctan-4-yl]-1-[(2-methyl-1-oxo-3-phenethylsulfonylpropyl)amino]urea IUPAC Name: 1-tert-butyl-3-[(3S)-3-hydroxy-7-methyl-1-phenyloctan-4-yl]-1-[(2-methyl-3-phenethylsulfonylpropanoyl)amino]urea Traditional Name: 1-tert-butyl-3-[1-[(1S)-1-hydroxy-3-phenyl-propyl]-4-methyl-pentyl]-1-[(2-methyl-3-phenethylsulfonyl-propanoyl)amino]urea Formula: C32H49N3O5S MolecularWeight: 587.81356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C(CCC1=CC=CC=C1)O)NC(=O)N(C(C)(C)C)NC(=O)C(C)CS(=O)(=O)CCC2=CC=CC=C2

Isomeric SMILES

CC(C)CCC([C@H](CCC1=CC=CC=C1)O)NC(=O)N(C(C)(C)C)NC(=O)C(C)CS(=O)(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C32H49N3O5S/c1-24(2)17-19-28(29(36)20-18-26-13-9-7-10-14-26)33-31(38)35(32(4,5)6)34-30(37)25(3)23-41(39,40)22-21-27-15-11-8-12-16-27/h7-16,24-25,28-29,36H,17-23H2,1-6H3,(H,33,38)(H,34,37)/t25?,28?,29-/m0/s1