2-(4-pyrrol-1-ylphenyl)-1-[4-(thiophen-2-ylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(4-pyrrol-1-ylphenyl)-1-[4-(thiophen-2-ylmethyl)piperazin-1-yl]ethanone Openeye Name: 2-(4-pyrrol-1-ylphenyl)-1-[4-(2-thienylmethyl)piperazin-1-yl]ethanone CAS Name: 2-[4-(1-pyrrolyl)phenyl]-1-[4-(thiophen-2-ylmethyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-pyrrol-1-ylphenyl)-1-[4-(thiophen-2-ylmethyl)piperazin-1-yl]ethanone Traditional Name: 2-(4-pyrrol-1-ylphenyl)-1-[4-(2-thenyl)piperazino]ethanone Formula: C21H23N3OS MolecularWeight: 365.49182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CS2)C(=O)CC3=CC=C(C=C3)N4C=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CS2)C(=O)CC3=CC=C(C=C3)N4C=CC=C4

InChI

InChI=1S/C21H23N3OS/c25-21(16-18-5-7-19(8-6-18)23-9-1-2-10-23)24-13-11-22(12-14-24)17-20-4-3-15-26-20/h1-10,15H,11-14,16-17H2