2-[[(2S)-2-[[(2S)-2-azanyl-4-methyl-pentanoyl]amino]-4-methylsulfanyl-butanoyl]amino]-2-oxidanyl-ethanoic acid

Systemtic Name: 2-[[(2S)-2-[[(2S)-2-azanyl-4-methyl-pentanoyl]amino]-4-methylsulfanyl-butanoyl]amino]-2-oxidanyl-ethanoic acid Openeye Name: 2-[[(2S)-2-[[(2S)-2-amino-4-methyl-pentanoyl]amino]-4-methylsulfanyl-butanoyl]amino]-2-hydroxy-acetic acid CAS Name: 2-[[(2S)-2-[[(2S)-2-amino-4-methyl-1-oxopentyl]amino]-4-(methylthio)-1-oxobutyl]amino]-2-hydroxyacetic acid IUPAC Name: 2-[[(2S)-2-[[(2S)-2-amino-4-methylpentanoyl]amino]-4-methylsulfanylbutanoyl]amino]-2-hydroxyacetic acid Traditional Name: 2-[[(2S)-2-[[(2S)-2-amino-4-methyl-pentanoyl]amino]-4-(methylthio)butanoyl]amino]-2-hydroxy-acetic acid Formula: C13H25N3O5S MolecularWeight: 335.4197

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)C[C@@H](C(=O)N[C@@H](CCSC)C(=O)NC(C(=O)O)O)N

InChI

InChI=1S/C13H25N3O5S/c1-7(2)6-8(14)10(17)15-9(4-5-22-3)11(18)16-12(19)13(20)21/h7-9,12,19H,4-6,14H2,1-3H3,(H,15,17)(H,16,18)(H,20,21)/t8-,9-,12?/m0/s1