(5-chloranylthiophen-2-yl)methyl-[2-[4-(4-ethanoylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-[2-[4-(4-ethanoylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [2-[4-(4-acetylphenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]-[(5-chloro-2-thienyl)methyl]-methyl-ammonium CAS Name: [2-[4-(4-acetylphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-[(5-chloro-2-thiophenyl)methyl]-methylammonium IUPAC Name: [2-[4-(4-acetylphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]-[(5-chlorothiophen-2-yl)methyl]-methylazanium Traditional Name: [2-[4-(4-acetylphenyl)sulfonylpiperazino]-2-keto-ethyl]-[(5-chloro-2-thienyl)methyl]-methyl-ammonium Formula: C20H25ClN3O4S2+ MolecularWeight: 471.0132

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C[NH+](C)CC3=CC=C(S3)Cl

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C[NH+](C)CC3=CC=C(S3)Cl

InChI

InChI=1S/C20H24ClN3O4S2/c1-15(25)16-3-6-18(7-4-16)30(27,28)24-11-9-23(10-12-24)20(26)14-22(2)13-17-5-8-19(21)29-17/h3-8H,9-14H2,1-2H3/p+1