N-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)-2-thiophen-2-yl-ethyl]-2,2-diphenyl-ethanamide

Systemtic Name: N-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)-2-thiophen-2-yl-ethyl]-2,2-diphenyl-ethanamide Openeye Name: N-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)-2-(2-thienyl)ethyl]-2,2-diphenyl-acetamide CAS Name: N-[(2R)-2-(4-methyl-1-piperazin-4-iumyl)-2-thiophen-2-ylethyl]-2,2-diphenylacetamide IUPAC Name: N-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)-2-thiophen-2-ylethyl]-2,2-diphenylacetamide Traditional Name: N-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)-2-(2-thienyl)ethyl]-2,2-diphenyl-acetamide Formula: C25H30N3OS+ MolecularWeight: 420.5902

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(CNC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

C[NH+]1CCN(CC1)[C@H](CNC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C25H29N3OS/c1-27-14-16-28(17-15-27)22(23-13-8-18-30-23)19-26-25(29)24(20-9-4-2-5-10-20)21-11-6-3-7-12-21/h2-13,18,22,24H,14-17,19H2,1H3,(H,26,29)/p+1/t22-/m1/s1