2-phenyl-4-[[4-phenyl-5-(piperidin-1-ium-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole

Systemtic Name: 2-phenyl-4-[[4-phenyl-5-(piperidin-1-ium-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole Openeye Name: 2-phenyl-4-[[4-phenyl-5-(piperidin-1-ium-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]thiazole CAS Name: 2-phenyl-4-[[[4-phenyl-5-(1-piperidin-1-iumylmethyl)-1,2,4-triazol-3-yl]thio]methyl]thiazole IUPAC Name: 2-phenyl-4-[[4-phenyl-5-(piperidin-1-ium-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole Traditional Name: 2-phenyl-4-[[[4-phenyl-5-(piperidin-1-ium-1-ylmethyl)-1,2,4-triazol-3-yl]thio]methyl]thiazole Formula: C24H26N5S2+ MolecularWeight: 448.62674

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=NN=C(N2C3=CC=CC=C3)SCC4=CSC(=N4)C5=CC=CC=C5

Isomeric SMILES

C1CC[NH+](CC1)CC2=NN=C(N2C3=CC=CC=C3)SCC4=CSC(=N4)C5=CC=CC=C5

InChI

InChI=1S/C24H25N5S2/c1-4-10-19(11-5-1)23-25-20(17-30-23)18-31-24-27-26-22(16-28-14-8-3-9-15-28)29(24)21-12-6-2-7-13-21/h1-2,4-7,10-13,17H,3,8-9,14-16,18H2/p+1