[2-oxidanylidene-2-[phenethyl-(phenylmethyl)amino]ethyl] 3-(thiophen-2-ylcarbonylamino)propanoate

Systemtic Name: [2-oxidanylidene-2-[phenethyl-(phenylmethyl)amino]ethyl] 3-(thiophen-2-ylcarbonylamino)propanoate Openeye Name: [2-[benzyl(phenethyl)amino]-2-oxo-ethyl] 3-(thiophene-2-carbonylamino)propanoate CAS Name: 3-[[oxo(thiophen-2-yl)methyl]amino]propanoic acid [2-oxo-2-[phenethyl-(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-[benzyl(phenethyl)amino]-2-oxoethyl] 3-(thiophene-2-carbonylamino)propanoate Traditional Name: 3-(2-thenoylamino)propionic acid [2-[benzyl(phenethyl)amino]-2-keto-ethyl] ester Formula: C25H26N2O4S MolecularWeight: 450.54994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)C(=O)COC(=O)CCNC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)C(=O)COC(=O)CCNC(=O)C3=CC=CS3

InChI

InChI=1S/C25H26N2O4S/c28-23(19-31-24(29)13-15-26-25(30)22-12-7-17-32-22)27(18-21-10-5-2-6-11-21)16-14-20-8-3-1-4-9-20/h1-12,17H,13-16,18-19H2,(H,26,30)