2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-1-(4-piperidin-1-ylcarbonylpiperazin-1-yl)ethanone

Systemtic Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-1-(4-piperidin-1-ylcarbonylpiperazin-1-yl)ethanone Openeye Name: 2-indan-5-ylsulfanyl-1-[4-(piperidine-1-carbonyl)piperazin-1-yl]ethanone CAS Name: 2-(2,3-dihydro-1H-inden-5-ylthio)-1-[4-[oxo(1-piperidinyl)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-1-[4-(piperidine-1-carbonyl)piperazin-1-yl]ethanone Traditional Name: 2-(indan-5-ylthio)-1-[4-(piperidine-1-carbonyl)piperazino]ethanone Formula: C21H29N3O2S MolecularWeight: 387.53886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)N2CCN(CC2)C(=O)CSC3=CC4=C(CCC4)C=C3

Isomeric SMILES

C1CCN(CC1)C(=O)N2CCN(CC2)C(=O)CSC3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C21H29N3O2S/c25-20(16-27-19-8-7-17-5-4-6-18(17)15-19)22-11-13-24(14-12-22)21(26)23-9-2-1-3-10-23/h7-8,15H,1-6,9-14,16H2