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

Systemtic Name: 2-methyl-N-(4-methylpiperazin-4-ium-1-yl)-4-phenyl-1,3-thiazole-5-carboxamide Openeye Name: 2-methyl-N-(4-methylpiperazin-4-ium-1-yl)-4-phenyl-thiazole-5-carboxamide CAS Name: 2-methyl-N-(4-methyl-1-piperazin-4-iumyl)-4-phenyl-5-thiazolecarboxamide IUPAC Name: 2-methyl-N-(4-methylpiperazin-4-ium-1-yl)-4-phenyl-1,3-thiazole-5-carboxamide Traditional Name: 2-methyl-N-(4-methylpiperazin-4-ium-1-yl)-4-phenyl-thiazole-5-carboxamide Formula: C16H21N4OS+ MolecularWeight: 317.42914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(S1)C(=O)NN2CC[NH+](CC2)C)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=C(S1)C(=O)NN2CC[NH+](CC2)C)C3=CC=CC=C3

InChI

InChI=1S/C16H20N4OS/c1-12-17-14(13-6-4-3-5-7-13)15(22-12)16(21)18-20-10-8-19(2)9-11-20/h3-7H,8-11H2,1-2H3,(H,18,21)/p+1