1-[(1S)-4-(4-chlorophenyl)sulfanyl-2,3-dihydro-1H-inden-1-yl]-4-methyl-piperazine-1,4-diium

Systemtic Name: 1-[(1S)-4-(4-chlorophenyl)sulfanyl-2,3-dihydro-1H-inden-1-yl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[(1S)-4-(4-chlorophenyl)sulfanylindan-1-yl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[(1S)-4-[(4-chlorophenyl)thio]-2,3-dihydro-1H-inden-1-yl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[(1S)-4-(4-chlorophenyl)sulfanyl-2,3-dihydro-1H-inden-1-yl]-4-methylpiperazine-1,4-diium Traditional Name: 1-[(1S)-4-[(4-chlorophenyl)thio]indan-1-yl]-4-methyl-piperazine-1,4-diium Formula: C20H25ClN2S+2 MolecularWeight: 360.9439

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)C2CCC3=C2C=CC=C3SC4=CC=C(C=C4)Cl

Isomeric SMILES

C[NH+]1CC[NH+](CC1)[C@H]2CCC3=C2C=CC=C3SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H23ClN2S/c1-22-11-13-23(14-12-22)19-10-9-18-17(19)3-2-4-20(18)24-16-7-5-15(21)6-8-16/h2-8,19H,9-14H2,1H3/p+2/t19-/m0/s1