N-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(4-methoxyphenyl)-N-(2-thienylmethyl)-2-[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)-2-(4-thiophen-2-ylsulfonyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(4-methoxyphenyl)-N-(2-thenyl)-2-[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]acetamide Formula: C22H26N3O4S3+ MolecularWeight: 492.65454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CC2=CC=CS2)C(=O)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)N(CC2=CC=CS2)C(=O)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

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