methyl 2-[[2-(aminocarbonylamino)-4-methylsulfanyl-butanoyl]amino]-2-methyl-pentanoate

Systemtic Name: methyl 2-[[2-(aminocarbonylamino)-4-methylsulfanyl-butanoyl]amino]-2-methyl-pentanoate Openeye Name: methyl 2-methyl-2-[(4-methylsulfanyl-2-ureido-butanoyl)amino]pentanoate CAS Name: 2-[[2-(carbamoylamino)-4-(methylthio)-1-oxobutyl]amino]-2-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[2-(carbamoylamino)-4-methylsulfanylbutanoyl]amino]-2-methylpentanoate Traditional Name: 2-methyl-2-[[4-(methylthio)-2-ureido-butanoyl]amino]valeric acid methyl ester Formula: C13H25N3O4S MolecularWeight: 319.4203

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(=O)OC)NC(=O)C(CCSC)NC(=O)N

Isomeric SMILES

CCCC(C)(C(=O)OC)NC(=O)C(CCSC)NC(=O)N

InChI

InChI=1S/C13H25N3O4S/c1-5-7-13(2,11(18)20-3)16-10(17)9(6-8-21-4)15-12(14)19/h9H,5-8H2,1-4H3,(H,16,17)(H3,14,15,19)