2-[2-[[2-[(2-azanyl-4-methyl-pentanoyl)amino]-4-methylsulfanyl-butanoyl]amino]ethanoylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[2-[[2-[(2-azanyl-4-methyl-pentanoyl)amino]-4-methylsulfanyl-butanoyl]amino]ethanoylamino]-4-methyl-pentanoic acid Openeye Name: 2-[[2-[[2-[(2-amino-4-methyl-pentanoyl)amino]-4-methylsulfanyl-butanoyl]amino]acetyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[2-[[2-[(2-amino-4-methyl-1-oxopentyl)amino]-4-(methylthio)-1-oxobutyl]amino]-1-oxoethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[2-[[2-[(2-amino-4-methylpentanoyl)amino]-4-methylsulfanylbutanoyl]amino]acetyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[2-[[2-[(2-amino-4-methyl-pentanoyl)amino]-4-(methylthio)butanoyl]amino]acetyl]amino]-4-methyl-valeric acid Formula: C19H36N4O5S MolecularWeight: 432.57794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H36N4O5S/c1-11(2)8-13(20)17(25)23-14(6-7-29-5)18(26)21-10-16(24)22-15(19(27)28)9-12(3)4/h11-15H,6-10,20H2,1-5H3,(H,21,26)(H,22,24)(H,23,25)(H,27,28)