5-[[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]methyl]-3-thiophen-3-yl-1,2,4-oxadiazole

Systemtic Name: 5-[[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]methyl]-3-thiophen-3-yl-1,2,4-oxadiazole Openeye Name: 5-[[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]methyl]-3-(3-thienyl)-1,2,4-oxadiazole CAS Name: 5-[[4-(1,3-benzothiazol-2-yl)-1-piperidin-1-iumyl]methyl]-3-(3-thiophenyl)-1,2,4-oxadiazole IUPAC Name: 5-[[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]methyl]-3-thiophen-3-yl-1,2,4-oxadiazole Traditional Name: 5-[[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]methyl]-3-(3-thienyl)-1,2,4-oxadiazole Formula: C19H19N4OS2+ MolecularWeight: 383.51036

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2=NC3=CC=CC=C3S2)CC4=NC(=NO4)C5=CSC=C5

Isomeric SMILES

C1C[NH+](CCC1C2=NC3=CC=CC=C3S2)CC4=NC(=NO4)C5=CSC=C5

InChI

InChI=1S/C19H18N4OS2/c1-2-4-16-15(3-1)20-19(26-16)13-5-8-23(9-6-13)11-17-21-18(22-24-17)14-7-10-25-12-14/h1-4,7,10,12-13H,5-6,8-9,11H2/p+1