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

Systemtic Name: 3-azanyl-4-[[1-[[1-(carboxymethylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-amino-4-[[1-[[1-(carboxymethylcarbamoyl)-3-methylsulfanyl-propyl]carbamoyl]-2-methyl-propyl]amino]-4-oxo-butanoic acid CAS Name: 3-amino-4-[[1-[[1-(carboxymethylamino)-4-(methylthio)-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: 3-amino-4-[[1-[[1-(carboxymethylamino)-4-methylsulfanyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-4-oxobutanoic acid Traditional Name: 3-amino-4-[[1-[[1-(carboxymethylcarbamoyl)-3-(methylthio)propyl]carbamoyl]-2-methyl-propyl]amino]-4-keto-butyric acid Formula: C16H28N4O7S MolecularWeight: 420.48112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H28N4O7S/c1-8(2)13(20-14(25)9(17)6-11(21)22)16(27)19-10(4-5-28-3)15(26)18-7-12(23)24/h8-10,13H,4-7,17H2,1-3H3,(H,18,26)(H,19,27)(H,20,25)(H,21,22)(H,23,24)