2-[2-[[2-[(2-azanyl-4-methyl-pentanoyl)amino]-3-sulfanyl-propanoyl]amino]ethanoylamino]-3-oxidanyl-butanoic acid

Systemtic Name: 2-[2-[[2-[(2-azanyl-4-methyl-pentanoyl)amino]-3-sulfanyl-propanoyl]amino]ethanoylamino]-3-oxidanyl-butanoic acid Openeye Name: 2-[[2-[[2-[(2-amino-4-methyl-pentanoyl)amino]-3-sulfanyl-propanoyl]amino]acetyl]amino]-3-hydroxy-butanoic acid CAS Name: 2-[[2-[[2-[(2-amino-4-methyl-1-oxopentyl)amino]-3-mercapto-1-oxopropyl]amino]-1-oxoethyl]amino]-3-hydroxybutanoic acid IUPAC Name: 2-[[2-[[2-[(2-amino-4-methylpentanoyl)amino]-3-sulfanylpropanoyl]amino]acetyl]amino]-3-hydroxybutanoic acid Traditional Name: 2-[[2-[[2-[(2-amino-4-methyl-pentanoyl)amino]-3-mercapto-propanoyl]amino]acetyl]amino]-3-hydroxy-butyric acid Formula: C15H28N4O6S MolecularWeight: 392.47102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CS)C(=O)NCC(=O)NC(C(C)O)C(=O)O)N

Isomeric SMILES

CC(C)CC(C(=O)NC(CS)C(=O)NCC(=O)NC(C(C)O)C(=O)O)N

InChI

InChI=1S/C15H28N4O6S/c1-7(2)4-9(16)13(22)18-10(6-26)14(23)17-5-11(21)19-12(8(3)20)15(24)25/h7-10,12,20,26H,4-6,16H2,1-3H3,(H,17,23)(H,18,22)(H,19,21)(H,24,25)