N-[(1R,2S)-1-[4-(5-methanoylthiophen-2-yl)piperazin-1-ium-1-yl]-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide

Systemtic Name: N-[(1R,2S)-1-[4-(5-methanoylthiophen-2-yl)piperazin-1-ium-1-yl]-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide Openeye Name: N-[(1R,2S)-1-[4-(5-formyl-2-thienyl)piperazin-1-ium-1-yl]indan-2-yl]benzenesulfonamide CAS Name: N-[(1R,2S)-1-[4-(5-formyl-2-thiophenyl)-1-piperazin-1-iumyl]-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide IUPAC Name: N-[(1R,2S)-1-[4-(5-formylthiophen-2-yl)piperazin-1-ium-1-yl]-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide Traditional Name: N-[(1R,2S)-1-[4-(5-formyl-2-thienyl)piperazin-1-ium-1-yl]indan-2-yl]benzenesulfonamide Formula: C24H26N3O3S2+ MolecularWeight: 468.61154

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2C(CC3=CC=CC=C23)NS(=O)(=O)C4=CC=CC=C4)C5=CC=C(S5)C=O

Isomeric SMILES

C1CN(CC[NH+]1[C@H]2[C@H](CC3=CC=CC=C23)NS(=O)(=O)C4=CC=CC=C4)C5=CC=C(S5)C=O

InChI

InChI=1S/C24H25N3O3S2/c28-17-19-10-11-23(31-19)26-12-14-27(15-13-26)24-21-9-5-4-6-18(21)16-22(24)25-32(29,30)20-7-2-1-3-8-20/h1-11,17,22,24-25H,12-16H2/p+1/t22-,24+/m0/s1