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

Systemtic Name: methyl 2-(2-tert-butylsulfanylethanoylamino)-4-methyl-pentanoate Openeye Name: methyl 2-[(2-tert-butylsulfanylacetyl)amino]-4-methyl-pentanoate CAS Name: 2-[[2-(tert-butylthio)-1-oxoethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[(2-tert-butylsulfanylacetyl)amino]-4-methylpentanoate Traditional Name: 2-[[2-(tert-butylthio)acetyl]amino]-4-methyl-valeric acid methyl ester Formula: C13H25NO3S MolecularWeight: 275.4075

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)CSC(C)(C)C

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)CSC(C)(C)C

InChI

InChI=1S/C13H25NO3S/c1-9(2)7-10(12(16)17-6)14-11(15)8-18-13(3,4)5/h9-10H,7-8H2,1-6H3,(H,14,15)