[2-oxidanylidene-2-[4-(phenylcarbamoyl)piperazin-1-yl]ethyl] 3-(thiophen-2-ylcarbonylamino)benzoate

Systemtic Name: [2-oxidanylidene-2-[4-(phenylcarbamoyl)piperazin-1-yl]ethyl] 3-(thiophen-2-ylcarbonylamino)benzoate Openeye Name: [2-oxo-2-[4-(phenylcarbamoyl)piperazin-1-yl]ethyl] 3-(thiophene-2-carbonylamino)benzoate CAS Name: 3-[[oxo(thiophen-2-yl)methyl]amino]benzoic acid [2-[4-[anilino(oxo)methyl]-1-piperazinyl]-2-oxoethyl] ester IUPAC Name: [2-oxo-2-[4-(phenylcarbamoyl)piperazin-1-yl]ethyl] 3-(thiophene-2-carbonylamino)benzoate Traditional Name: 3-(2-thenoylamino)benzoic acid [2-keto-2-[4-(phenylcarbamoyl)piperazino]ethyl] ester Formula: C25H24N4O5S MolecularWeight: 492.54686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)COC(=O)C2=CC(=CC=C2)NC(=O)C3=CC=CS3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)COC(=O)C2=CC(=CC=C2)NC(=O)C3=CC=CS3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C25H24N4O5S/c30-22(28-11-13-29(14-12-28)25(33)27-19-7-2-1-3-8-19)17-34-24(32)18-6-4-9-20(16-18)26-23(31)21-10-5-15-35-21/h1-10,15-16H,11-14,17H2,(H,26,31)(H,27,33)