tert-butyl N-[(2S)-3-(1H-indol-3-yl)-1-oxidanylidene-1-[(2-propan-2-ylphenyl)amino]propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-3-(1H-indol-3-yl)-1-oxidanylidene-1-[(2-propan-2-ylphenyl)amino]propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-(1H-indol-3-ylmethyl)-2-(2-isopropylanilino)-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-3-(1H-indol-3-yl)-1-oxo-1-(2-propan-2-ylanilino)propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-3-(1H-indol-3-yl)-1-oxo-1-(2-propan-2-ylanilino)propan-2-yl]carbamate Traditional Name: N-[(1S)-1-(1H-indol-3-ylmethyl)-2-(2-isopropylanilino)-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=O)[C@H](CC2=CNC3=CC=CC=C32)NC(=O)OC(C)(C)C

InChI

InChI=1S/C25H31N3O3/c1-16(2)18-10-6-9-13-21(18)27-23(29)22(28-24(30)31-25(3,4)5)14-17-15-26-20-12-8-7-11-19(17)20/h6-13,15-16,22,26H,14H2,1-5H3,(H,27,29)(H,28,30)/t22-/m0/s1