S-[2-[2-(phenylmethoxycarbonylamino)ethanoylamino]ethyl] ethanethioate

Systemtic Name: S-[2-[2-(phenylmethoxycarbonylamino)ethanoylamino]ethyl] ethanethioate Openeye Name: S-[2-[[2-(benzyloxycarbonylamino)acetyl]amino]ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[[1-oxo-2-(phenylmethoxycarbonylamino)ethyl]amino]ethyl] ester IUPAC Name: S-[2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]ethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[[2-(benzyloxycarbonylamino)acetyl]amino]ethyl] ester Formula: C14H18N2O4S MolecularWeight: 310.36872

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCNC(=O)CNC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(=O)SCCNC(=O)CNC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C14H18N2O4S/c1-11(17)21-8-7-15-13(18)9-16-14(19)20-10-12-5-3-2-4-6-12/h2-6H,7-10H2,1H3,(H,15,18)(H,16,19)