2-[[4-methyl-2-[[2-[[2-[[4-methyl-1-oxidanylidene-1-[(1-oxidanyl-1-oxidanylidene-propan-2-yl)amino]pentan-2-yl]carbamoyl]phenyl]disulfanyl]phenyl]carbonylamino]pentanoyl]amino]propanoic acid

Systemtic Name: 2-[[4-methyl-2-[[2-[[2-[[4-methyl-1-oxidanylidene-1-[(1-oxidanyl-1-oxidanylidene-propan-2-yl)amino]pentan-2-yl]carbamoyl]phenyl]disulfanyl]phenyl]carbonylamino]pentanoyl]amino]propanoic acid Openeye Name: 2-[[2-[[2-[[2-[[1-[(2-hydroxy-1-methyl-2-oxo-ethyl)carbamoyl]-3-methyl-butyl]carbamoyl]phenyl]disulfanyl]benzoyl]amino]-4-methyl-pentanoyl]amino]propanoic acid CAS Name: 2-[[2-[[[2-[[2-[[[1-[(1-hydroxy-1-oxopropan-2-yl)amino]-4-methyl-1-oxopentan-2-yl]amino]-oxomethyl]phenyl]disulfanyl]phenyl]-oxomethyl]amino]-4-methyl-1-oxopentyl]amino]propanoic acid IUPAC Name: 2-[[2-[[2-[[2-[[1-[(1-hydroxy-1-oxopropan-2-yl)amino]-4-methyl-1-oxopentan-2-yl]carbamoyl]phenyl]disulfanyl]benzoyl]amino]-4-methylpentanoyl]amino]propanoic acid Traditional Name: 2-[[2-[[2-[[2-[[1-[(2-hydroxy-2-keto-1-methyl-ethyl)carbamoyl]-3-methyl-butyl]carbamoyl]phenyl]disulfanyl]benzoyl]amino]-4-methyl-pentanoyl]amino]propionic acid Formula: C32H42N4O8S2 MolecularWeight: 674.82788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(C)C(=O)O)NC(=O)C1=CC=CC=C1SSC2=CC=CC=C2C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)O

Isomeric SMILES

CC(C)CC(C(=O)NC(C)C(=O)O)NC(=O)C1=CC=CC=C1SSC2=CC=CC=C2C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)O

InChI

InChI=1S/C32H42N4O8S2/c1-17(2)15-23(29(39)33-19(5)31(41)42)35-27(37)21-11-7-9-13-25(21)45-46-26-14-10-8-12-22(26)28(38)36-24(16-18(3)4)30(40)34-20(6)32(43)44/h7-14,17-20,23-24H,15-16H2,1-6H3,(H,33,39)(H,34,40)(H,35,37)(H,36,38)(H,41,42)(H,43,44)