3-tert-butyl-1-(2-methylpropyl)-1-[(2R,3S)-2-oxidanyl-4-phenyl-3-[(phenylmethyl)amino]butyl]urea

Systemtic Name: 3-tert-butyl-1-(2-methylpropyl)-1-[(2R,3S)-2-oxidanyl-4-phenyl-3-[(phenylmethyl)amino]butyl]urea Openeye Name: 1-[(2R,3S)-3-(benzylamino)-2-hydroxy-4-phenyl-butyl]-3-tert-butyl-1-isobutyl-urea CAS Name: 3-tert-butyl-1-[(2R,3S)-2-hydroxy-4-phenyl-3-[(phenylmethyl)amino]butyl]-1-(2-methylpropyl)urea IUPAC Name: 1-[(2R,3S)-3-(benzylamino)-2-hydroxy-4-phenylbutyl]-3-tert-butyl-1-(2-methylpropyl)urea Traditional Name: 1-[(2R,3S)-3-(benzylamino)-2-hydroxy-4-phenyl-butyl]-3-tert-butyl-1-isobutyl-urea Formula: C26H39N3O2 MolecularWeight: 425.60676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C(CC1=CC=CC=C1)NCC2=CC=CC=C2)O)C(=O)NC(C)(C)C

Isomeric SMILES

CC(C)CN(C[C@H]([C@H](CC1=CC=CC=C1)NCC2=CC=CC=C2)O)C(=O)NC(C)(C)C

InChI

InChI=1S/C26H39N3O2/c1-20(2)18-29(25(31)28-26(3,4)5)19-24(30)23(16-21-12-8-6-9-13-21)27-17-22-14-10-7-11-15-22/h6-15,20,23-24,27,30H,16-19H2,1-5H3,(H,28,31)/t23-,24+/m0/s1