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

Systemtic Name: 3-azanyl-4-[[3-methyl-1-[2-[(4-methylsulfanyl-1-oxidanyl-1-oxidanylidene-butan-2-yl)carbamoyl]pyrrolidin-1-yl]-1-oxidanylidene-butan-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-amino-4-[[1-[2-[(1-carboxy-3-methylsulfanyl-propyl)carbamoyl]pyrrolidine-1-carbonyl]-2-methyl-propyl]amino]-4-oxo-butanoic acid CAS Name: 3-amino-4-[[1-[2-[[[1-hydroxy-4-(methylthio)-1-oxobutan-2-yl]amino]-oxomethyl]-1-pyrrolidinyl]-3-methyl-1-oxobutan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: 3-amino-4-[[1-[2-[(1-hydroxy-4-methylsulfanyl-1-oxobutan-2-yl)carbamoyl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]amino]-4-oxobutanoic acid Traditional Name: 3-amino-4-[[1-[2-[[1-carboxy-3-(methylthio)propyl]carbamoyl]pyrrolidine-1-carbonyl]-2-methyl-propyl]amino]-4-keto-butyric acid Formula: C19H32N4O7S MolecularWeight: 460.54498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCCC1C(=O)NC(CCSC)C(=O)O)NC(=O)C(CC(=O)O)N

Isomeric SMILES

CC(C)C(C(=O)N1CCCC1C(=O)NC(CCSC)C(=O)O)NC(=O)C(CC(=O)O)N

InChI

InChI=1S/C19H32N4O7S/c1-10(2)15(22-16(26)11(20)9-14(24)25)18(28)23-7-4-5-13(23)17(27)21-12(19(29)30)6-8-31-3/h10-13,15H,4-9,20H2,1-3H3,(H,21,27)(H,22,26)(H,24,25)(H,29,30)