N-(4-phenoxyphenyl)-2-[4-(phenylcarbamothioyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(4-phenoxyphenyl)-2-[4-(phenylcarbamothioyl)piperazin-1-yl]ethanamide Openeye Name: N-(4-phenoxyphenyl)-2-[4-(phenylcarbamothioyl)piperazin-1-yl]acetamide CAS Name: 2-[4-[anilino(sulfanylidene)methyl]-1-piperazinyl]-N-(4-phenoxyphenyl)acetamide IUPAC Name: N-(4-phenoxyphenyl)-2-[4-(phenylcarbamothioyl)piperazin-1-yl]acetamide Traditional Name: N-(4-phenoxyphenyl)-2-[4-(phenylthiocarbamoyl)piperazino]acetamide Formula: C25H26N4O2S MolecularWeight: 446.56454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)C(=S)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)C(=S)NC4=CC=CC=C4

InChI

InChI=1S/C25H26N4O2S/c30-24(26-21-11-13-23(14-12-21)31-22-9-5-2-6-10-22)19-28-15-17-29(18-16-28)25(32)27-20-7-3-1-4-8-20/h1-14H,15-19H2,(H,26,30)(H,27,32)