methyl (2S)-2-[[(2S)-2-[[2-[2-[[(2S)-1-[[(2S)-1-methoxy-3-methyl-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]phenyl]phenyl]carbonylamino]-3-phenyl-propanoyl]amino]-3-methyl-butanoate

Systemtic Name: methyl (2S)-2-[[(2S)-2-[[2-[2-[[(2S)-1-[[(2S)-1-methoxy-3-methyl-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]phenyl]phenyl]carbonylamino]-3-phenyl-propanoyl]amino]-3-methyl-butanoate Openeye Name: methyl (2S)-2-[[(2S)-2-[[2-[2-[[(1S)-1-benzyl-2-[[(1S)-1-methoxycarbonyl-2-methyl-propyl]amino]-2-oxo-ethyl]carbamoyl]phenyl]benzoyl]amino]-3-phenyl-propanoyl]amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(2S)-2-[[[2-[2-[[[(2S)-1-[[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]phenyl]phenyl]-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2S)-2-[[2-[2-[[(2S)-1-[[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamoyl]phenyl]benzoyl]amino]-3-phenylpropanoyl]amino]-3-methylbutanoate Traditional Name: (2S)-2-[[(2S)-2-[[2-[2-[[(1S)-1-benzyl-2-[[(1S)-1-carbomethoxy-2-methyl-propyl]amino]-2-keto-ethyl]carbamoyl]phenyl]benzoyl]amino]-3-phenyl-propanoyl]amino]-3-methyl-butyric acid methyl ester Formula: C44H50N4O8 MolecularWeight: 762.8898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC=CC=C2C3=CC=CC=C3C(=O)NC(CC4=CC=CC=C4)C(=O)NC(C(C)C)C(=O)OC

Isomeric SMILES

CC(C)[C@@H](C(=O)OC)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C2=CC=CC=C2C3=CC=CC=C3C(=O)N[C@@H](CC4=CC=CC=C4)C(=O)N[C@@H](C(C)C)C(=O)OC

InChI

InChI=1S/C44H50N4O8/c1-27(2)37(43(53)55-5)47-41(51)35(25-29-17-9-7-10-18-29)45-39(49)33-23-15-13-21-31(33)32-22-14-16-24-34(32)40(50)46-36(26-30-19-11-8-12-20-30)42(52)48-38(28(3)4)44(54)56-6/h7-24,27-28,35-38H,25-26H2,1-6H3,(H,45,49)(H,46,50)(H,47,51)(H,48,52)/t35-,36-,37-,38-/m0/s1