1-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-4-ium-1-yl]-2-[(5-methyl-1,2-oxazol-3-yl)oxy]ethanone

Systemtic Name: 1-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-4-ium-1-yl]-2-[(5-methyl-1,2-oxazol-3-yl)oxy]ethanone Openeye Name: 1-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-4-ium-1-yl]-2-(5-methylisoxazol-3-yl)oxy-ethanone CAS Name: 1-[4-(1,3-benzothiazol-2-ylmethyl)-1-piperazin-4-iumyl]-2-[(5-methyl-3-isoxazolyl)oxy]ethanone IUPAC Name: 1-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-4-ium-1-yl]-2-[(5-methyl-1,2-oxazol-3-yl)oxy]ethanone Traditional Name: 1-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-4-ium-1-yl]-2-(5-methylisoxazol-3-yl)oxy-ethanone Formula: C18H21N4O3S+ MolecularWeight: 373.44934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)OCC(=O)N2CC[NH+](CC2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=NO1)OCC(=O)N2CC[NH+](CC2)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H20N4O3S/c1-13-10-16(20-25-13)24-12-18(23)22-8-6-21(7-9-22)11-17-19-14-4-2-3-5-15(14)26-17/h2-5,10H,6-9,11-12H2,1H3/p+1