N-methyl-N-[4-[2-oxidanylidene-2-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]ethoxy]phenyl]thiophene-2-sulfonamide

Systemtic Name: N-methyl-N-[4-[2-oxidanylidene-2-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]ethoxy]phenyl]thiophene-2-sulfonamide Openeye Name: N-methyl-N-[4-[2-oxo-2-[4-(2-thienylmethyl)piperazin-4-ium-1-yl]ethoxy]phenyl]thiophene-2-sulfonamide CAS Name: N-methyl-N-[4-[2-oxo-2-[4-(thiophen-2-ylmethyl)-1-piperazin-4-iumyl]ethoxy]phenyl]-2-thiophenesulfonamide IUPAC Name: N-methyl-N-[4-[2-oxo-2-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]ethoxy]phenyl]thiophene-2-sulfonamide Traditional Name: N-[4-[2-keto-2-[4-(2-thenyl)piperazin-4-ium-1-yl]ethoxy]phenyl]-N-methyl-thiophene-2-sulfonamide Formula: C22H26N3O4S3+ MolecularWeight: 492.65454

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OCC(=O)N2CC[NH+](CC2)CC3=CC=CS3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CN(C1=CC=C(C=C1)OCC(=O)N2CC[NH+](CC2)CC3=CC=CS3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C22H25N3O4S3/c1-23(32(27,28)22-5-3-15-31-22)18-6-8-19(9-7-18)29-17-21(26)25-12-10-24(11-13-25)16-20-4-2-14-30-20/h2-9,14-15H,10-13,16-17H2,1H3/p+1