methyl 2-(3-butoxypropylcarbamoylamino)-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-(3-butoxypropylcarbamoylamino)-4-methylsulfanyl-butanoate Openeye Name: methyl 2-(3-butoxypropylcarbamoylamino)-4-methylsulfanyl-butanoate CAS Name: 2-[[(3-butoxypropylamino)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-(3-butoxypropylcarbamoylamino)-4-methylsulfanylbutanoate Traditional Name: 2-(3-butoxypropylcarbamoylamino)-4-(methylthio)butyric acid methyl ester Formula: C14H28N2O4S MolecularWeight: 320.44812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCCNC(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CCCCOCCCNC(=O)NC(CCSC)C(=O)OC

InChI

InChI=1S/C14H28N2O4S/c1-4-5-9-20-10-6-8-15-14(18)16-12(7-11-21-3)13(17)19-2/h12H,4-11H2,1-3H3,(H2,15,16,18)