methyl (2S)-2-[[(2S,3S)-3-methyl-2-[[(2S)-3-methyl-2-[[(2S)-5-oxidanylidenepyrrolidin-2-yl]carbonylamino]butanoyl]amino]pentanoyl]amino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2S)-2-[[(2S,3S)-3-methyl-2-[[(2S)-3-methyl-2-[[(2S)-5-oxidanylidenepyrrolidin-2-yl]carbonylamino]butanoyl]amino]pentanoyl]amino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2S)-2-[[(2S,3S)-3-methyl-2-[[(2S)-3-methyl-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]butanoyl]amino]pentanoyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[(2S,3S)-3-methyl-2-[[(2S)-3-methyl-1-oxo-2-[[oxo-[(2S)-5-oxo-2-pyrrolidinyl]methyl]amino]butyl]amino]-1-oxopentyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2S,3S)-3-methyl-2-[[(2S)-3-methyl-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]butanoyl]amino]pentanoyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-5-ketoprolyl]amino]-3-methyl-butanoyl]amino]-3-methyl-pentanoyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C22H38N4O6S MolecularWeight: 486.62532

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CCSC)C(=O)OC)NC(=O)C(C(C)C)NC(=O)C1CCC(=O)N1

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H](CCSC)C(=O)OC)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCC(=O)N1

InChI

InChI=1S/C22H38N4O6S/c1-7-13(4)18(21(30)24-15(10-11-33-6)22(31)32-5)26-20(29)17(12(2)3)25-19(28)14-8-9-16(27)23-14/h12-15,17-18H,7-11H2,1-6H3,(H,23,27)(H,24,30)(H,25,28)(H,26,29)/t13-,14-,15-,17-,18-/m0/s1