2-(2,3-dimethoxyphenyl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(2,3-dimethoxyphenyl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(2,3-dimethoxyphenyl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]thiazole-4-carboxamide CAS Name: 2-(2,3-dimethoxyphenyl)-N-[4-(4-ethyl-1-piperazin-4-iumyl)-2-methylphenyl]-4-thiazolecarboxamide IUPAC Name: 2-(2,3-dimethoxyphenyl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methylphenyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-(2,3-dimethoxyphenyl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]thiazole-4-carboxamide Formula: C25H31N4O3S+ MolecularWeight: 467.60364

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=CSC(=N3)C4=C(C(=CC=C4)OC)OC)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=CSC(=N3)C4=C(C(=CC=C4)OC)OC)C

InChI

InChI=1S/C25H30N4O3S/c1-5-28-11-13-29(14-12-28)18-9-10-20(17(2)15-18)26-24(30)21-16-33-25(27-21)19-7-6-8-22(31-3)23(19)32-4/h6-10,15-16H,5,11-14H2,1-4H3,(H,26,30)/p+1