S-[2-[3-(phenylmethoxycarbonylamino)propanoylamino]ethyl] 2,2-dimethylpropanethioate

Systemtic Name: S-[2-[3-(phenylmethoxycarbonylamino)propanoylamino]ethyl] 2,2-dimethylpropanethioate Openeye Name: S-[2-[3-(benzyloxycarbonylamino)propanoylamino]ethyl] 2,2-dimethylpropanethioate CAS Name: 2,2-dimethylpropanethioic acid S-[2-[[1-oxo-3-(phenylmethoxycarbonylamino)propyl]amino]ethyl] ester IUPAC Name: S-[2-[3-(phenylmethoxycarbonylamino)propanoylamino]ethyl] 2,2-dimethylpropanethioate Traditional Name: 2,2-dimethylpropanethioic acid S-[2-[3-(benzyloxycarbonylamino)propanoylamino]ethyl] ester Formula: C18H26N2O4S MolecularWeight: 366.47504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)SCCNC(=O)CCNC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)C(=O)SCCNC(=O)CCNC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C18H26N2O4S/c1-18(2,3)16(22)25-12-11-19-15(21)9-10-20-17(23)24-13-14-7-5-4-6-8-14/h4-8H,9-13H2,1-3H3,(H,19,21)(H,20,23)