(2R)-2-[4-(4-cyanophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-methylphenyl)-2-phenyl-ethanamide

Systemtic Name: (2R)-2-[4-(4-cyanophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-methylphenyl)-2-phenyl-ethanamide Openeye Name: (2R)-2-[4-(4-cyanophenyl)sulfonylpiperazin-1-ium-1-yl]-2-phenyl-N-(p-tolyl)acetamide CAS Name: (2R)-2-[4-(4-cyanophenyl)sulfonyl-1-piperazin-1-iumyl]-N-(4-methylphenyl)-2-phenylacetamide IUPAC Name: (2R)-2-[4-(4-cyanophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-methylphenyl)-2-phenylacetamide Traditional Name: (2R)-2-[4-(4-cyanophenyl)sulfonylpiperazin-1-ium-1-yl]-2-phenyl-N-(p-tolyl)acetamide Formula: C26H27N4O3S+ MolecularWeight: 475.58258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)[NH+]3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)[C@@H](C2=CC=CC=C2)[NH+]3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C26H26N4O3S/c1-20-7-11-23(12-8-20)28-26(31)25(22-5-3-2-4-6-22)29-15-17-30(18-16-29)34(32,33)24-13-9-21(19-27)10-14-24/h2-14,25H,15-18H2,1H3,(H,28,31)/p+1/t25-/m1/s1