tert-butyl N-[(2S)-1-[[(2S)-1-[[(2R)-1-azanyl-3-cyclohexyl-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-[[(2S)-1-[[(2R)-1-azanyl-3-cyclohexyl-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-2-[[(1S)-2-[[(1R)-1-(aminomethyl)-2-cyclohexyl-ethyl]amino]-1-benzyl-2-oxo-ethyl]amino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-[[(2S)-1-[[(2R)-1-amino-3-cyclohexylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-[[(2S)-1-[[(2R)-1-amino-3-cyclohexylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1S)-2-[[(1S)-2-[[(1R)-1-(aminomethyl)-2-cyclohexyl-ethyl]amino]-1-benzyl-2-keto-ethyl]amino]-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C34H47N5O4 MolecularWeight: 589.76808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC(CC3=CC=CC=C3)C(=O)NC(CC4CCCCC4)CN

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N[C@H](CC4CCCCC4)CN

InChI

InChI=1S/C34H47N5O4/c1-34(2,3)43-33(42)39-30(20-25-22-36-28-17-11-10-16-27(25)28)32(41)38-29(19-24-14-8-5-9-15-24)31(40)37-26(21-35)18-23-12-6-4-7-13-23/h5,8-11,14-17,22-23,26,29-30,36H,4,6-7,12-13,18-21,35H2,1-3H3,(H,37,40)(H,38,41)(H,39,42)/t26-,29+,30+/m1/s1