2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-1-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]ethanone

Systemtic Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-1-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]ethanone Openeye Name: 1-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-indan-5-ylsulfanyl-ethanone CAS Name: 2-(2,3-dihydro-1H-inden-5-ylthio)-1-[2-(3,4-dimethoxyphenyl)-1-pyrrolidinyl]ethanone IUPAC Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-1-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]ethanone Traditional Name: 1-[2-(3,4-dimethoxyphenyl)pyrrolidino]-2-(indan-5-ylthio)ethanone Formula: C23H27NO3S MolecularWeight: 397.53038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CCCN2C(=O)CSC3=CC4=C(CCC4)C=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CCCN2C(=O)CSC3=CC4=C(CCC4)C=C3)OC

InChI

InChI=1S/C23H27NO3S/c1-26-21-11-9-18(14-22(21)27-2)20-7-4-12-24(20)23(25)15-28-19-10-8-16-5-3-6-17(16)13-19/h8-11,13-14,20H,3-7,12,15H2,1-2H3