(phenylmethyl) 3-(2-azanylethylsulfanylcarbonylamino)propanoate

Systemtic Name: (phenylmethyl) 3-(2-azanylethylsulfanylcarbonylamino)propanoate Openeye Name: benzyl 3-(2-aminoethylsulfanylcarbonylamino)propanoate CAS Name: 3-[[(2-aminoethylthio)-oxomethyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(2-aminoethylsulfanylcarbonylamino)propanoate Traditional Name: 3-[(2-aminoethylthio)carbonylamino]propionic acid benzyl ester Formula: C13H18N2O3S MolecularWeight: 282.35862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCNC(=O)SCCN

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCNC(=O)SCCN

InChI

InChI=1S/C13H18N2O3S/c14-7-9-19-13(17)15-8-6-12(16)18-10-11-4-2-1-3-5-11/h1-5H,6-10,14H2,(H,15,17)