(2R)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]-2-phenyl-2-phenylsulfanyl-ethanamide

Systemtic Name: (2R)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]-2-phenyl-2-phenylsulfanyl-ethanamide Openeye Name: (2R)-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]-2-phenyl-2-phenylsulfanyl-acetamide CAS Name: (2R)-N-[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]-2-phenyl-2-(phenylthio)acetamide IUPAC Name: (2R)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]-2-phenyl-2-phenylsulfanylacetamide Traditional Name: (2R)-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]-2-phenyl-2-(phenylthio)acetamide Formula: C24H27N4OS+ MolecularWeight: 419.56238

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)C(C3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)[C@@H](C3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C24H26N4OS/c1-27-14-16-28(17-15-27)22-13-12-20(18-25-22)26-24(29)23(19-8-4-2-5-9-19)30-21-10-6-3-7-11-21/h2-13,18,23H,14-17H2,1H3,(H,26,29)/p+1/t23-/m1/s1