2-(4-methylphenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(4-methylphenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-1,3-thiazole-4-carboxamide Openeye Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-(p-tolyl)thiazole-4-carboxamide CAS Name: 2-(4-methylphenyl)-N-[2-(4-methyl-1-piperazin-4-iumyl)phenyl]-4-thiazolecarboxamide IUPAC Name: 2-(4-methylphenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-1,3-thiazole-4-carboxamide Traditional Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-(p-tolyl)thiazole-4-carboxamide Formula: C22H25N4OS+ MolecularWeight: 393.5251

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)C(=O)NC3=CC=CC=C3N4CC[NH+](CC4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)C(=O)NC3=CC=CC=C3N4CC[NH+](CC4)C

InChI

InChI=1S/C22H24N4OS/c1-16-7-9-17(10-8-16)22-24-19(15-28-22)21(27)23-18-5-3-4-6-20(18)26-13-11-25(2)12-14-26/h3-10,15H,11-14H2,1-2H3,(H,23,27)/p+1