2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(4-phenylphenyl)methylideneamino]ethanamide

Systemtic Name: 2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(4-phenylphenyl)methylideneamino]ethanamide Openeye Name: N-[(4-phenylphenyl)methyleneamino]-2-[4-(p-tolylsulfonyl)piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-(4-methylphenyl)sulfonyl-1-piperazin-1-iumyl]-N-[(4-phenylphenyl)methylideneamino]acetamide IUPAC Name: 2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(4-phenylphenyl)methylideneamino]acetamide Traditional Name: N-[(4-phenylbenzylidene)amino]-2-(4-tosylpiperazin-1-ium-1-yl)acetamide Formula: C26H29N4O3S+ MolecularWeight: 477.59846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NN=CC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NN=CC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H28N4O3S/c1-21-7-13-25(14-8-21)34(32,33)30-17-15-29(16-18-30)20-26(31)28-27-19-22-9-11-24(12-10-22)23-5-3-2-4-6-23/h2-14,19H,15-18,20H2,1H3,(H,28,31)/p+1