[(2S)-3-[[(2S)-1-[(4-cyanophenyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-propyl] ethanoate

Systemtic Name: [(2S)-3-[[(2S)-1-[(4-cyanophenyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-propyl] ethanoate Openeye Name: [(2S)-3-[[(1S)-1-benzyl-2-(4-cyanoanilino)-2-oxo-ethyl]amino]-2-(tert-butoxycarbonylamino)-3-oxo-propyl] acetate CAS Name: acetic acid [(2S)-3-[[(2S)-1-(4-cyanoanilino)-1-oxo-3-phenylpropan-2-yl]amino]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxopropyl] ester IUPAC Name: [(2S)-3-[[(2S)-1-(4-cyanoanilino)-1-oxo-3-phenylpropan-2-yl]amino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl] acetate Traditional Name: acetic acid [(2S)-3-[[(1S)-1-benzyl-2-(4-cyanoanilino)-2-keto-ethyl]amino]-2-(tert-butoxycarbonylamino)-3-keto-propyl] ester Formula: C26H30N4O6 MolecularWeight: 494.5396

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(C(=O)NC(CC1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)C#N)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)OC[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)C#N)NC(=O)OC(C)(C)C

InChI

InChI=1S/C26H30N4O6/c1-17(31)35-16-22(30-25(34)36-26(2,3)4)24(33)29-21(14-18-8-6-5-7-9-18)23(32)28-20-12-10-19(15-27)11-13-20/h5-13,21-22H,14,16H2,1-4H3,(H,28,32)(H,29,33)(H,30,34)/t21-,22-/m0/s1