2-(heptylcarbamoylamino)-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-(heptylcarbamoylamino)-4-methylsulfanyl-butanoic acid Openeye Name: 2-(heptylcarbamoylamino)-4-methylsulfanyl-butanoic acid CAS Name: 2-[[(heptylamino)-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-(heptylcarbamoylamino)-4-methylsulfanylbutanoic acid Traditional Name: 2-(heptylcarbamoylamino)-4-(methylthio)butyric acid Formula: C13H26N2O3S MolecularWeight: 290.42214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=O)NC(CCSC)C(=O)O

Isomeric SMILES

CCCCCCCNC(=O)NC(CCSC)C(=O)O

InChI

InChI=1S/C13H26N2O3S/c1-3-4-5-6-7-9-14-13(18)15-11(12(16)17)8-10-19-2/h11H,3-10H2,1-2H3,(H,16,17)(H2,14,15,18)