(phenylmethyl) 2-[3-(phenylmethoxycarbonylamino)propanoylamino]ethylsulfanylmethanoate

Systemtic Name: (phenylmethyl) 2-[3-(phenylmethoxycarbonylamino)propanoylamino]ethylsulfanylmethanoate Openeye Name: benzyl 2-[3-(benzyloxycarbonylamino)propanoylamino]ethylsulfanylformate CAS Name: [2-[[1-oxo-3-(phenylmethoxycarbonylamino)propyl]amino]ethylthio]formic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]ethylsulfanylformate Traditional Name: [2-[3-(benzyloxycarbonylamino)propanoylamino]ethylthio]formic acid benzyl ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCCC(=O)NCCSC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCCC(=O)NCCSC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H24N2O5S/c24-19(11-12-23-20(25)27-15-17-7-3-1-4-8-17)22-13-14-29-21(26)28-16-18-9-5-2-6-10-18/h1-10H,11-16H2,(H,22,24)(H,23,25)