N-(4-methoxyphenyl)-2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: N-(4-methoxyphenyl)-2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-(4-methoxyphenyl)-2-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]-N-(2-thienylmethyl)acetamide CAS Name: N-(4-methoxyphenyl)-2-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazin-4-iumyl]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-(4-methoxyphenyl)-2-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-4-ium-1-yl]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[4-(2-keto-2-pyrrolidino-ethyl)piperazin-4-ium-1-yl]-N-(4-methoxyphenyl)-N-(2-thenyl)acetamide Formula: C24H33N4O3S+ MolecularWeight: 457.60882

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CC2=CC=CS2)C(=O)CN3CC[NH+](CC3)CC(=O)N4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)N(CC2=CC=CS2)C(=O)CN3CC[NH+](CC3)CC(=O)N4CCCC4

InChI

InChI=1S/C24H32N4O3S/c1-31-21-8-6-20(7-9-21)28(17-22-5-4-16-32-22)24(30)19-26-14-12-25(13-15-26)18-23(29)27-10-2-3-11-27/h4-9,16H,2-3,10-15,17-19H2,1H3/p+1