2-[[2-(aminocarbonylamino)-4-methylsulfanyl-butanoyl]amino]-3,3-dimethyl-butanoic acid

Systemtic Name: 2-[[2-(aminocarbonylamino)-4-methylsulfanyl-butanoyl]amino]-3,3-dimethyl-butanoic acid Openeye Name: 3,3-dimethyl-2-[(4-methylsulfanyl-2-ureido-butanoyl)amino]butanoic acid CAS Name: 2-[[2-(carbamoylamino)-4-(methylthio)-1-oxobutyl]amino]-3,3-dimethylbutanoic acid IUPAC Name: 2-[[2-(carbamoylamino)-4-methylsulfanylbutanoyl]amino]-3,3-dimethylbutanoic acid Traditional Name: 3,3-dimethyl-2-[[4-(methylthio)-2-ureido-butanoyl]amino]butyric acid Formula: C12H23N3O4S MolecularWeight: 305.39372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H23N3O4S/c1-12(2,3)8(10(17)18)15-9(16)7(5-6-20-4)14-11(13)19/h7-8H,5-6H2,1-4H3,(H,15,16)(H,17,18)(H3,13,14,19)