1-(diphenylmethyl)-4-thiophen-2-ylsulfonyl-piperazin-1-ium

Systemtic Name: 1-(diphenylmethyl)-4-thiophen-2-ylsulfonyl-piperazin-1-ium Openeye Name: 1-benzhydryl-4-(2-thienylsulfonyl)piperazin-1-ium CAS Name: 1-(diphenylmethyl)-4-thiophen-2-ylsulfonylpiperazin-1-ium IUPAC Name: 1-benzhydryl-4-thiophen-2-ylsulfonylpiperazin-1-ium Traditional Name: 1-benzhydryl-4-(2-thienylsulfonyl)piperazin-1-ium Formula: C21H23N2O2S2+ MolecularWeight: 399.54952

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H22N2O2S2/c24-27(25,20-12-7-17-26-20)23-15-13-22(14-16-23)21(18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-12,17,21H,13-16H2/p+1