2-(ethoxycarbonylamino)-2-methyl-3-[2-(prop-1-en-2-ylamino)ethylsulfanyl]propanoic acid

Systemtic Name: 2-(ethoxycarbonylamino)-2-methyl-3-[2-(prop-1-en-2-ylamino)ethylsulfanyl]propanoic acid Openeye Name: 2-(ethoxycarbonylamino)-3-[2-(isopropenylamino)ethylsulfanyl]-2-methyl-propanoic acid CAS Name: 2-(ethoxycarbonylamino)-2-methyl-3-[2-(1-methylethenylamino)ethylthio]propanoic acid IUPAC Name: 2-(ethoxycarbonylamino)-2-methyl-3-[2-(prop-1-en-2-ylamino)ethylsulfanyl]propanoic acid Traditional Name: 2-(carbethoxyamino)-3-[2-(isopropenylamino)ethylthio]-2-methyl-propionic acid Formula: C12H22N2O4S MolecularWeight: 290.37908

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(C)(CSCCNC(=C)C)C(=O)O

Isomeric SMILES

CCOC(=O)NC(C)(CSCCNC(=C)C)C(=O)O

InChI

InChI=1S/C12H22N2O4S/c1-5-18-11(17)14-12(4,10(15)16)8-19-7-6-13-9(2)3/h13H,2,5-8H2,1,3-4H3,(H,14,17)(H,15,16)