4-[[[(2S)-2-azanyl-3-methyl-butanoyl]amino]methylamino]-2-methylsulfonyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[[(2S)-2-azanyl-3-methyl-butanoyl]amino]methylamino]-2-methylsulfonyl-4-oxidanylidene-butanoic acid Openeye Name: 4-[[[(2S)-2-amino-3-methyl-butanoyl]amino]methylamino]-2-methylsulfonyl-4-oxo-butanoic acid CAS Name: 4-[[[(2S)-2-amino-3-methyl-1-oxobutyl]amino]methylamino]-2-methylsulfonyl-4-oxobutanoic acid IUPAC Name: 4-[[[(2S)-2-amino-3-methylbutanoyl]amino]methylamino]-2-methylsulfonyl-4-oxobutanoic acid Traditional Name: 4-[[[(2S)-2-amino-3-methyl-butanoyl]amino]methylamino]-4-keto-2-mesyl-butyric acid Formula: C11H21N3O6S MolecularWeight: 323.36594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCNC(=O)CC(C(=O)O)S(=O)(=O)C)N

Isomeric SMILES

CC(C)[C@@H](C(=O)NCNC(=O)CC(C(=O)O)S(=O)(=O)C)N

InChI

InChI=1S/C11H21N3O6S/c1-6(2)9(12)10(16)14-5-13-8(15)4-7(11(17)18)21(3,19)20/h6-7,9H,4-5,12H2,1-3H3,(H,13,15)(H,14,16)(H,17,18)/t7?,9-/m0/s1