tert-butyl (4S)-4-benzamido-5-[[(2S)-1-(cyclohexylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-4-methyl-5-oxidanylidene-pentanoate

Systemtic Name: tert-butyl (4S)-4-benzamido-5-[[(2S)-1-(cyclohexylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-4-methyl-5-oxidanylidene-pentanoate Openeye Name: tert-butyl (4S)-4-benzamido-5-[[(1S)-1-benzyl-2-(cyclohexylamino)-2-oxo-ethyl]amino]-4-methyl-5-oxo-pentanoate CAS Name: (4S)-4-benzamido-5-[[(2S)-1-(cyclohexylamino)-1-oxo-3-phenylpropan-2-yl]amino]-4-methyl-5-oxopentanoic acid tert-butyl ester IUPAC Name: tert-butyl (4S)-4-benzamido-5-[[(2S)-1-(cyclohexylamino)-1-oxo-3-phenylpropan-2-yl]amino]-4-methyl-5-oxopentanoate Traditional Name: (4S)-4-benzamido-5-[[(1S)-1-benzyl-2-(cyclohexylamino)-2-keto-ethyl]amino]-5-keto-4-methyl-valeric acid tert-butyl ester Formula: C32H43N3O5 MolecularWeight: 549.70092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC(C)(C(=O)NC(CC1=CC=CC=C1)C(=O)NC2CCCCC2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@](CCC(=O)OC(C)(C)C)(C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NC2CCCCC2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C32H43N3O5/c1-31(2,3)40-27(36)20-21-32(4,35-28(37)24-16-10-6-11-17-24)30(39)34-26(22-23-14-8-5-9-15-23)29(38)33-25-18-12-7-13-19-25/h5-6,8-11,14-17,25-26H,7,12-13,18-22H2,1-4H3,(H,33,38)(H,34,39)(H,35,37)/t26-,32-/m0/s1