N-[4-(4-ethoxyphenoxy)phenyl]-2-(4-thiophen-2-ylcarbonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[4-(4-ethoxyphenoxy)phenyl]-2-(4-thiophen-2-ylcarbonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[4-(4-ethoxyphenoxy)phenyl]-2-[4-(thiophene-2-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[4-(4-ethoxyphenoxy)phenyl]-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[4-(4-ethoxyphenoxy)phenyl]-2-[4-(thiophene-2-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-[4-(4-ethoxyphenoxy)phenyl]-2-[4-(2-thenoyl)piperazin-1-ium-1-yl]acetamide Formula: C25H28N3O4S+ MolecularWeight: 466.57252

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C25H27N3O4S/c1-2-31-20-9-11-22(12-10-20)32-21-7-5-19(6-8-21)26-24(29)18-27-13-15-28(16-14-27)25(30)23-4-3-17-33-23/h3-12,17H,2,13-16,18H2,1H3,(H,26,29)/p+1