6-azanyl-2-[[1-(3-ethanoylsulfanyl-2-methyl-propanoyl)pyrrolidin-2-yl]carbonylamino]hexanoic acid

Systemtic Name: 6-azanyl-2-[[1-(3-ethanoylsulfanyl-2-methyl-propanoyl)pyrrolidin-2-yl]carbonylamino]hexanoic acid Openeye Name: 2-[[1-(3-acetylsulfanyl-2-methyl-propanoyl)pyrrolidine-2-carbonyl]amino]-6-amino-hexanoic acid CAS Name: 2-[[[1-[3-(acetylthio)-2-methyl-1-oxopropyl]-2-pyrrolidinyl]-oxomethyl]amino]-6-aminohexanoic acid IUPAC Name: 2-[[1-(3-acetylsulfanyl-2-methylpropanoyl)pyrrolidine-2-carbonyl]amino]-6-aminohexanoic acid Traditional Name: 2-[[1-[3-(acetylthio)-2-methyl-propanoyl]prolyl]amino]-6-amino-hexanoic acid Formula: C17H29N3O5S MolecularWeight: 387.49426

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)N1CCCC1C(=O)NC(CCCCN)C(=O)O

Isomeric SMILES

CC(CSC(=O)C)C(=O)N1CCCC1C(=O)NC(CCCCN)C(=O)O

InChI

InChI=1S/C17H29N3O5S/c1-11(10-26-12(2)21)16(23)20-9-5-7-14(20)15(22)19-13(17(24)25)6-3-4-8-18/h11,13-14H,3-10,18H2,1-2H3,(H,19,22)(H,24,25)