3-tert-butyl-1-(3-methylbutyl)-1-[(2R)-2-oxidanyl-3-[(phenylmethyl)amino]propyl]urea

Systemtic Name: 3-tert-butyl-1-(3-methylbutyl)-1-[(2R)-2-oxidanyl-3-[(phenylmethyl)amino]propyl]urea Openeye Name: 1-[(2R)-3-(benzylamino)-2-hydroxy-propyl]-3-tert-butyl-1-isopentyl-urea CAS Name: 3-tert-butyl-1-[(2R)-2-hydroxy-3-[(phenylmethyl)amino]propyl]-1-(3-methylbutyl)urea IUPAC Name: 1-[(2R)-3-(benzylamino)-2-hydroxypropyl]-3-tert-butyl-1-(3-methylbutyl)urea Traditional Name: 1-[(2R)-3-(benzylamino)-2-hydroxy-propyl]-3-tert-butyl-1-isoamyl-urea Formula: C20H35N3O2 MolecularWeight: 349.5108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CC(CNCC1=CC=CC=C1)O)C(=O)NC(C)(C)C

Isomeric SMILES

CC(C)CCN(C[C@@H](CNCC1=CC=CC=C1)O)C(=O)NC(C)(C)C

InChI

InChI=1S/C20H35N3O2/c1-16(2)11-12-23(19(25)22-20(3,4)5)15-18(24)14-21-13-17-9-7-6-8-10-17/h6-10,16,18,21,24H,11-15H2,1-5H3,(H,22,25)/t18-/m1/s1