4-[[4-(1,3-benzothiazol-2-yl)piperazin-1-ium-1-yl]methyl]-2-(furan-2-yl)-5-methyl-1,3-oxazole

Systemtic Name: 4-[[4-(1,3-benzothiazol-2-yl)piperazin-1-ium-1-yl]methyl]-2-(furan-2-yl)-5-methyl-1,3-oxazole Openeye Name: 4-[[4-(1,3-benzothiazol-2-yl)piperazin-1-ium-1-yl]methyl]-2-(2-furyl)-5-methyl-oxazole CAS Name: 4-[[4-(1,3-benzothiazol-2-yl)-1-piperazin-1-iumyl]methyl]-2-(2-furanyl)-5-methyloxazole IUPAC Name: 4-[[4-(1,3-benzothiazol-2-yl)piperazin-1-ium-1-yl]methyl]-2-(furan-2-yl)-5-methyl-1,3-oxazole Traditional Name: 4-[[4-(1,3-benzothiazol-2-yl)piperazin-1-ium-1-yl]methyl]-2-(2-furyl)-5-methyl-oxazole Formula: C20H21N4O2S+ MolecularWeight: 381.47134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CO2)C[NH+]3CCN(CC3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CO2)C[NH+]3CCN(CC3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C20H20N4O2S/c1-14-16(21-19(26-14)17-6-4-12-25-17)13-23-8-10-24(11-9-23)20-22-15-5-2-3-7-18(15)27-20/h2-7,12H,8-11,13H2,1H3/p+1