(phenylmethyl) 3-(1H-indol-3-yl)-2-(thiophen-3-ylmethoxycarbonylamino)propanoate

Systemtic Name: (phenylmethyl) 3-(1H-indol-3-yl)-2-(thiophen-3-ylmethoxycarbonylamino)propanoate Openeye Name: benzyl 3-(1H-indol-3-yl)-2-(3-thienylmethoxycarbonylamino)propanoate CAS Name: 3-(1H-indol-3-yl)-2-[[oxo(3-thiophenylmethoxy)methyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(1H-indol-3-yl)-2-(thiophen-3-ylmethoxycarbonylamino)propanoate Traditional Name: 3-(1H-indol-3-yl)-2-(3-thenyloxycarbonylamino)propionic acid benzyl ester Formula: C24H22N2O4S MolecularWeight: 434.50748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)OCC4=CSC=C4

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)OCC4=CSC=C4

InChI

InChI=1S/C24H22N2O4S/c27-23(29-14-17-6-2-1-3-7-17)22(26-24(28)30-15-18-10-11-31-16-18)12-19-13-25-21-9-5-4-8-20(19)21/h1-11,13,16,22,25H,12,14-15H2,(H,26,28)