4-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-phenyl-1,3-thiazole-5-carboxamide

Systemtic Name: 4-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-phenyl-1,3-thiazole-5-carboxamide Openeye Name: 4-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-phenyl-thiazole-5-carboxamide CAS Name: 4-methyl-N-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-2-phenyl-5-thiazolecarboxamide IUPAC Name: 4-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-phenyl-1,3-thiazole-5-carboxamide Traditional Name: 4-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-phenyl-thiazole-5-carboxamide Formula: C22H25N4O3S2+ MolecularWeight: 457.5889

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CC[NH+](CC4)C

InChI

InChI=1S/C22H24N4O3S2/c1-16-20(30-22(23-16)17-6-4-3-5-7-17)21(27)24-18-8-10-19(11-9-18)31(28,29)26-14-12-25(2)13-15-26/h3-11H,12-15H2,1-2H3,(H,24,27)/p+1