(5-chloranylthiophen-2-yl)methyl-methyl-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]azanium

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-methyl-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]azanium Openeye Name: (5-chloro-2-thienyl)methyl-methyl-[2-[4-(2-naphthylsulfonyl)piperazin-1-yl]-2-oxo-ethyl]ammonium CAS Name: (5-chloro-2-thiophenyl)methyl-methyl-[2-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-2-oxoethyl]ammonium IUPAC Name: (5-chlorothiophen-2-yl)methyl-methyl-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxoethyl]azanium Traditional Name: (5-chloro-2-thienyl)methyl-[2-keto-2-[4-(2-naphthylsulfonyl)piperazino]ethyl]-methyl-ammonium Formula: C22H25ClN3O3S2+ MolecularWeight: 479.0352

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(S1)Cl)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C[NH+](CC1=CC=C(S1)Cl)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H24ClN3O3S2/c1-24(15-19-7-9-21(23)30-19)16-22(27)25-10-12-26(13-11-25)31(28,29)20-8-6-17-4-2-3-5-18(17)14-20/h2-9,14H,10-13,15-16H2,1H3/p+1