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

Systemtic Name: 2-[2-[[2-[(2-azanyl-4-methyl-pentanoyl)amino]-3-sulfanyl-propanoyl]amino]ethanoylamino]-3-oxidanyl-propanoic acid Openeye Name: 2-[[2-[[2-[(2-amino-4-methyl-pentanoyl)amino]-3-sulfanyl-propanoyl]amino]acetyl]amino]-3-hydroxy-propanoic acid CAS Name: 2-[[2-[[2-[(2-amino-4-methyl-1-oxopentyl)amino]-3-mercapto-1-oxopropyl]amino]-1-oxoethyl]amino]-3-hydroxypropanoic acid IUPAC Name: 2-[[2-[[2-[(2-amino-4-methylpentanoyl)amino]-3-sulfanylpropanoyl]amino]acetyl]amino]-3-hydroxypropanoic acid Traditional Name: 2-[[2-[[2-[(2-amino-4-methyl-pentanoyl)amino]-3-mercapto-propanoyl]amino]acetyl]amino]-3-hydroxy-propionic acid Formula: C14H26N4O6S MolecularWeight: 378.44444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H26N4O6S/c1-7(2)3-8(15)12(21)18-10(6-25)13(22)16-4-11(20)17-9(5-19)14(23)24/h7-10,19,25H,3-6,15H2,1-2H3,(H,16,22)(H,17,20)(H,18,21)(H,23,24)