2-naphthalen-2-ylsulfanyl-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanone

Systemtic Name: 2-naphthalen-2-ylsulfanyl-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanone Openeye Name: 2-(2-naphthylsulfanyl)-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethanone CAS Name: 2-(2-naphthalenylthio)-1-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-naphthalen-2-ylsulfanyl-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethanone Traditional Name: 2-(2-naphthylthio)-1-[4-(2-thenoyl)piperazino]ethanone Formula: C21H20N2O2S2 MolecularWeight: 396.5257

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CSC2=CC3=CC=CC=C3C=C2)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)CSC2=CC3=CC=CC=C3C=C2)C(=O)C4=CC=CS4

InChI

InChI=1S/C21H20N2O2S2/c24-20(15-27-18-8-7-16-4-1-2-5-17(16)14-18)22-9-11-23(12-10-22)21(25)19-6-3-13-26-19/h1-8,13-14H,9-12,15H2