N-[(2S)-3-[2-ethyl-6-methyl-4-[5-[3-[(2-methylpropylamino)methyl]-5-propyl-phenyl]-1,2,4-oxadiazol-3-yl]phenoxy]-2-oxidanyl-propyl]-2-oxidanyl-ethanamide

Systemtic Name: N-[(2S)-3-[2-ethyl-6-methyl-4-[5-[3-[(2-methylpropylamino)methyl]-5-propyl-phenyl]-1,2,4-oxadiazol-3-yl]phenoxy]-2-oxidanyl-propyl]-2-oxidanyl-ethanamide Openeye Name: N-[(2S)-3-[2-ethyl-4-[5-[3-[(isobutylamino)methyl]-5-propyl-phenyl]-1,2,4-oxadiazol-3-yl]-6-methyl-phenoxy]-2-hydroxy-propyl]-2-hydroxy-acetamide CAS Name: N-[(2S)-3-[2-ethyl-6-methyl-4-[5-[3-[(2-methylpropylamino)methyl]-5-propylphenyl]-1,2,4-oxadiazol-3-yl]phenoxy]-2-hydroxypropyl]-2-hydroxyacetamide IUPAC Name: N-[(2S)-3-[2-ethyl-6-methyl-4-[5-[3-[(2-methylpropylamino)methyl]-5-propylphenyl]-1,2,4-oxadiazol-3-yl]phenoxy]-2-hydroxypropyl]-2-hydroxyacetamide Traditional Name: N-[(2S)-3-[2-ethyl-4-[5-[3-[(isobutylamino)methyl]-5-propyl-phenyl]-1,2,4-oxadiazol-3-yl]-6-methyl-phenoxy]-2-hydroxy-propyl]-2-hydroxy-acetamide Formula: C30H42N4O5 MolecularWeight: 538.67828

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=CC(=C1)C2=NC(=NO2)C3=CC(=C(C(=C3)CC)OCC(CNC(=O)CO)O)C)CNCC(C)C

Isomeric SMILES

CCCC1=CC(=CC(=C1)C2=NC(=NO2)C3=CC(=C(C(=C3)CC)OC[C@H](CNC(=O)CO)O)C)CNCC(C)C

InChI

InChI=1S/C30H42N4O5/c1-6-8-21-10-22(15-31-14-19(3)4)12-25(11-21)30-33-29(34-39-30)24-9-20(5)28(23(7-2)13-24)38-18-26(36)16-32-27(37)17-35/h9-13,19,26,31,35-36H,6-8,14-18H2,1-5H3,(H,32,37)/t26-/m0/s1