2-[(4-methylphenoxy)methyl]-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[(4-methylphenoxy)methyl]-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[(4-methylphenoxy)methyl]-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]thiazole-4-carboxamide CAS Name: 2-[(4-methylphenoxy)methyl]-N-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-4-thiazolecarboxamide IUPAC Name: 2-[(4-methylphenoxy)methyl]-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[(4-methylphenoxy)methyl]-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]thiazole-4-carboxamide Formula: C23H27N4O4S2+ MolecularWeight: 487.61488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC2=NC(=CS2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=CC=C(C=C1)OCC2=NC(=CS2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CC[NH+](CC4)C

InChI

InChI=1S/C23H26N4O4S2/c1-17-3-7-19(8-4-17)31-15-22-25-21(16-32-22)23(28)24-18-5-9-20(10-6-18)33(29,30)27-13-11-26(2)12-14-27/h3-10,16H,11-15H2,1-2H3,(H,24,28)/p+1