2-azanyl-N-[(2R)-3-(1H-indol-3-yl)-1-oxidanylidene-1-(4-phenylbutylamino)propan-2-yl]-2-methyl-propanamide

Systemtic Name: 2-azanyl-N-[(2R)-3-(1H-indol-3-yl)-1-oxidanylidene-1-(4-phenylbutylamino)propan-2-yl]-2-methyl-propanamide Openeye Name: 2-amino-N-[(1R)-1-(1H-indol-3-ylmethyl)-2-oxo-2-(4-phenylbutylamino)ethyl]-2-methyl-propanamide CAS Name: 2-amino-N-[(2R)-3-(1H-indol-3-yl)-1-oxo-1-(4-phenylbutylamino)propan-2-yl]-2-methylpropanamide IUPAC Name: 2-amino-N-[(2R)-3-(1H-indol-3-yl)-1-oxo-1-(4-phenylbutylamino)propan-2-yl]-2-methylpropanamide Traditional Name: 2-amino-N-[(1R)-1-(1H-indol-3-ylmethyl)-2-keto-2-(4-phenylbutylamino)ethyl]-2-methyl-propionamide Formula: C25H32N4O2 MolecularWeight: 420.54718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NCCCCC3=CC=CC=C3)N

Isomeric SMILES

CC(C)(C(=O)N[C@H](CC1=CNC2=CC=CC=C21)C(=O)NCCCCC3=CC=CC=C3)N

InChI

InChI=1S/C25H32N4O2/c1-25(2,26)24(31)29-22(16-19-17-28-21-14-7-6-13-20(19)21)23(30)27-15-9-8-12-18-10-4-3-5-11-18/h3-7,10-11,13-14,17,22,28H,8-9,12,15-16,26H2,1-2H3,(H,27,30)(H,29,31)/t22-/m1/s1