phenyl 2-[2-(phenylmethoxycarbonylamino)ethanethioylamino]ethanoate

Systemtic Name: phenyl 2-[2-(phenylmethoxycarbonylamino)ethanethioylamino]ethanoate Openeye Name: phenyl 2-[[2-(benzyloxycarbonylamino)ethanethioyl]amino]acetate CAS Name: 2-[[2-(phenylmethoxycarbonylamino)-1-sulfanylideneethyl]amino]acetic acid phenyl ester IUPAC Name: phenyl 2-[[2-(phenylmethoxycarbonylamino)ethanethioyl]amino]acetate Traditional Name: 2-[[2-(benzyloxycarbonylamino)thioacetyl]amino]acetic acid phenyl ester Formula: C18H18N2O4S MolecularWeight: 358.41152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCC(=S)NCC(=O)OC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCC(=S)NCC(=O)OC2=CC=CC=C2

InChI

InChI=1S/C18H18N2O4S/c21-17(24-15-9-5-2-6-10-15)12-19-16(25)11-20-18(22)23-13-14-7-3-1-4-8-14/h1-10H,11-13H2,(H,19,25)(H,20,22)