3-[4-[(2S)-3-(tert-butylamino)-2-oxidanyl-propoxy]-3-ethanoyl-phenyl]-1,1-diethyl-urea

Systemtic Name: 3-[4-[(2S)-3-(tert-butylamino)-2-oxidanyl-propoxy]-3-ethanoyl-phenyl]-1,1-diethyl-urea Openeye Name: 3-[3-acetyl-4-[(2S)-3-(tert-butylamino)-2-hydroxy-propoxy]phenyl]-1,1-diethyl-urea CAS Name: 3-[3-acetyl-4-[(2S)-3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1,1-diethylurea IUPAC Name: 3-[3-acetyl-4-[(2S)-3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1,1-diethylurea Traditional Name: 3-[3-acetyl-4-[(2S)-3-(tert-butylamino)-2-hydroxy-propoxy]phenyl]-1,1-diethyl-urea Formula: C20H33N3O4 MolecularWeight: 379.49372

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)NC1=CC(=C(C=C1)OCC(CNC(C)(C)C)O)C(=O)C

Isomeric SMILES

CCN(CC)C(=O)NC1=CC(=C(C=C1)OC[C@H](CNC(C)(C)C)O)C(=O)C

InChI

InChI=1S/C20H33N3O4/c1-7-23(8-2)19(26)22-15-9-10-18(17(11-15)14(3)24)27-13-16(25)12-21-20(4,5)6/h9-11,16,21,25H,7-8,12-13H2,1-6H3,(H,22,26)/t16-/m0/s1