5-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazol-6-yl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazol-6-yl]-1,2-oxazole-3-carboxamide Openeye Name: 5-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazol-6-yl]isoxazole-3-carboxamide CAS Name: 5-methyl-N-[2-(4-methyl-1-piperazin-4-iumyl)-1,3-benzothiazol-6-yl]-3-isoxazolecarboxamide IUPAC Name: 5-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazol-6-yl]-1,2-oxazole-3-carboxamide Traditional Name: 5-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazol-6-yl]isoxazole-3-carboxamide Formula: C17H20N5O2S+ MolecularWeight: 358.438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C(=O)NC2=CC3=C(C=C2)N=C(S3)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=CC(=NO1)C(=O)NC2=CC3=C(C=C2)N=C(S3)N4CC[NH+](CC4)C

InChI

InChI=1S/C17H19N5O2S/c1-11-9-14(20-24-11)16(23)18-12-3-4-13-15(10-12)25-17(19-13)22-7-5-21(2)6-8-22/h3-4,9-10H,5-8H2,1-2H3,(H,18,23)/p+1