[(2S)-3-cyclohexyl-2-[[(2R)-2-[2-oxidanylidene-2-[[(2S)-1-oxidanyl-3-phenyl-propan-2-yl]amino]ethyl]pent-4-enoyl]amino]propyl] (2S)-2-(phenylmethyl)pent-4-enoate

Systemtic Name: [(2S)-3-cyclohexyl-2-[[(2R)-2-[2-oxidanylidene-2-[[(2S)-1-oxidanyl-3-phenyl-propan-2-yl]amino]ethyl]pent-4-enoyl]amino]propyl] (2S)-2-(phenylmethyl)pent-4-enoate Openeye Name: [(2S)-2-[[(2R)-2-[2-[[(1S)-1-benzyl-2-hydroxy-ethyl]amino]-2-oxo-ethyl]pent-4-enoyl]amino]-3-cyclohexyl-propyl] (2S)-2-benzylpent-4-enoate CAS Name: (2S)-2-(phenylmethyl)-4-pentenoic acid [(2S)-3-cyclohexyl-2-[[(2R)-2-[2-[[(2S)-1-hydroxy-3-phenylpropan-2-yl]amino]-2-oxoethyl]-1-oxopent-4-enyl]amino]propyl] ester IUPAC Name: [(2S)-3-cyclohexyl-2-[[(2R)-2-[2-[[(2S)-1-hydroxy-3-phenylpropan-2-yl]amino]-2-oxoethyl]pent-4-enoyl]amino]propyl] (2S)-2-benzylpent-4-enoate Traditional Name: (2S)-2-benzylpent-4-enoic acid [(2S)-2-[[(2R)-2-[2-[[(1S)-1-benzyl-2-hydroxy-ethyl]amino]-2-keto-ethyl]pent-4-enoyl]amino]-3-cyclohexyl-propyl] ester Formula: C37H50N2O5 MolecularWeight: 602.8033

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(CC1=CC=CC=C1)C(=O)OCC(CC2CCCCC2)NC(=O)C(CC=C)CC(=O)NC(CC3=CC=CC=C3)CO

Isomeric SMILES

C=CC[C@@H](CC1=CC=CC=C1)C(=O)OC[C@H](CC2CCCCC2)NC(=O)[C@H](CC=C)CC(=O)N[C@@H](CC3=CC=CC=C3)CO

InChI

InChI=1S/C37H50N2O5/c1-3-14-31(25-35(41)38-33(26-40)23-29-18-10-6-11-19-29)36(42)39-34(24-30-20-12-7-13-21-30)27-44-37(43)32(15-4-2)22-28-16-8-5-9-17-28/h3-6,8-11,16-19,30-34,40H,1-2,7,12-15,20-27H2,(H,38,41)(H,39,42)/t31-,32+,33+,34+/m1/s1