1-(5-chloranylthiophen-2-yl)sulfonyl-4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-4-ium

Systemtic Name: 1-(5-chloranylthiophen-2-yl)sulfonyl-4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-4-ium Openeye Name: 1-[(5-chloro-2-thienyl)sulfonyl]-4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-4-ium CAS Name: 1-[(5-chloro-2-thiophenyl)sulfonyl]-4-[(4,5-dimethoxy-2-methylphenyl)methyl]piperazin-4-ium IUPAC Name: 1-(5-chlorothiophen-2-yl)sulfonyl-4-[(4,5-dimethoxy-2-methylphenyl)methyl]piperazin-4-ium Traditional Name: 1-[(5-chloro-2-thienyl)sulfonyl]-4-(4,5-dimethoxy-2-methyl-benzyl)piperazin-4-ium Formula: C18H24ClN2O4S2+ MolecularWeight: 431.97716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl)OC)OC

InChI

InChI=1S/C18H23ClN2O4S2/c1-13-10-15(24-2)16(25-3)11-14(13)12-20-6-8-21(9-7-20)27(22,23)18-5-4-17(19)26-18/h4-5,10-11H,6-9,12H2,1-3H3/p+1