(2S)-2-(2-tert-butylsulfanylethanoylamino)-4-methyl-pentanoate

Systemtic Name: (2S)-2-(2-tert-butylsulfanylethanoylamino)-4-methyl-pentanoate Openeye Name: (2S)-2-[(2-tert-butylsulfanylacetyl)amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[2-(tert-butylthio)-1-oxoethyl]amino]-4-methylpentanoate IUPAC Name: (2S)-2-[(2-tert-butylsulfanylacetyl)amino]-4-methylpentanoate Traditional Name: (2S)-2-[[2-(tert-butylthio)acetyl]amino]-4-methyl-valerate Formula: C12H22NO3S- MolecularWeight: 260.37298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NC(=O)CSC(C)(C)C

Isomeric SMILES

CC(C)C[C@@H](C(=O)[O-])NC(=O)CSC(C)(C)C

InChI

InChI=1S/C12H23NO3S/c1-8(2)6-9(11(15)16)13-10(14)7-17-12(3,4)5/h8-9H,6-7H2,1-5H3,(H,13,14)(H,15,16)/p-1/t9-/m0/s1