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

Systemtic Name: methyl 2-[[2-(aminocarbonylamino)-4-methylsulfanyl-butanoyl]amino]ethanoate Openeye Name: methyl 2-[(4-methylsulfanyl-2-ureido-butanoyl)amino]acetate CAS Name: 2-[[2-(carbamoylamino)-4-(methylthio)-1-oxobutyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-(carbamoylamino)-4-methylsulfanylbutanoyl]amino]acetate Traditional Name: 2-[[4-(methylthio)-2-ureido-butanoyl]amino]acetic acid methyl ester Formula: C9H17N3O4S MolecularWeight: 263.31398

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C(CCSC)NC(=O)N

Isomeric SMILES

COC(=O)CNC(=O)C(CCSC)NC(=O)N

InChI

InChI=1S/C9H17N3O4S/c1-16-7(13)5-11-8(14)6(3-4-17-2)12-9(10)15/h6H,3-5H2,1-2H3,(H,11,14)(H3,10,12,15)