2-[1-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperidin-1-ium-4-yl]-1,3-benzoxazole

Systemtic Name: 2-[1-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperidin-1-ium-4-yl]-1,3-benzoxazole Openeye Name: 2-[1-[[2-(3-thienyl)thiazol-4-yl]methyl]piperidin-1-ium-4-yl]-1,3-benzoxazole CAS Name: 2-[1-[[2-(3-thiophenyl)-4-thiazolyl]methyl]-4-piperidin-1-iumyl]-1,3-benzoxazole IUPAC Name: 2-[1-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperidin-1-ium-4-yl]-1,3-benzoxazole Traditional Name: 2-[1-[[2-(3-thienyl)thiazol-4-yl]methyl]piperidin-1-ium-4-yl]-1,3-benzoxazole Formula: C20H20N3OS2+ MolecularWeight: 382.5223

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2=NC3=CC=CC=C3O2)CC4=CSC(=N4)C5=CSC=C5

Isomeric SMILES

C1C[NH+](CCC1C2=NC3=CC=CC=C3O2)CC4=CSC(=N4)C5=CSC=C5

InChI

InChI=1S/C20H19N3OS2/c1-2-4-18-17(3-1)22-19(24-18)14-5-8-23(9-6-14)11-16-13-26-20(21-16)15-7-10-25-12-15/h1-4,7,10,12-14H,5-6,8-9,11H2/p+1