3-azanyl-4-[[1-[[1-(carboxymethylamino)-1-oxidanylidene-3-sulfanyl-propan-2-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-azanyl-4-[[1-[[1-(carboxymethylamino)-1-oxidanylidene-3-sulfanyl-propan-2-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-amino-4-[[1-[[2-(carboxymethylamino)-2-oxo-1-(sulfanylmethyl)ethyl]carbamoyl]-2-methyl-propyl]amino]-4-oxo-butanoic acid CAS Name: 3-amino-4-[[1-[[1-(carboxymethylamino)-3-mercapto-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: 3-amino-4-[[1-[[1-(carboxymethylamino)-1-oxo-3-sulfanylpropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-4-oxobutanoic acid Traditional Name: 3-amino-4-[[1-[[2-(carboxymethylamino)-2-keto-1-(mercaptomethyl)ethyl]carbamoyl]-2-methyl-propyl]amino]-4-keto-butyric acid Formula: C14H24N4O7S MolecularWeight: 392.42796

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H24N4O7S/c1-6(2)11(18-12(23)7(15)3-9(19)20)14(25)17-8(5-26)13(24)16-4-10(21)22/h6-8,11,26H,3-5,15H2,1-2H3,(H,16,24)(H,17,25)(H,18,23)(H,19,20)(H,21,22)