2-[[4-[(4-pyridin-4-yl-1,2,3-triazol-1-yl)methyl]piperidin-1-ium-1-yl]methyl]-1,3-thiazole

Systemtic Name: 2-[[4-[(4-pyridin-4-yl-1,2,3-triazol-1-yl)methyl]piperidin-1-ium-1-yl]methyl]-1,3-thiazole Openeye Name: 2-[[4-[[4-(4-pyridyl)triazol-1-yl]methyl]piperidin-1-ium-1-yl]methyl]thiazole CAS Name: 2-[[4-[(4-pyridin-4-yl-1-triazolyl)methyl]-1-piperidin-1-iumyl]methyl]thiazole IUPAC Name: 2-[[4-[(4-pyridin-4-yltriazol-1-yl)methyl]piperidin-1-ium-1-yl]methyl]-1,3-thiazole Traditional Name: 2-[[4-[[4-(4-pyridyl)triazol-1-yl]methyl]piperidin-1-ium-1-yl]methyl]thiazole Formula: C17H21N6S+ MolecularWeight: 341.45384

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CN2C=C(N=N2)C3=CC=NC=C3)CC4=NC=CS4

Isomeric SMILES

C1C[NH+](CCC1CN2C=C(N=N2)C3=CC=NC=C3)CC4=NC=CS4

InChI

InChI=1S/C17H20N6S/c1-5-18-6-2-15(1)16-12-23(21-20-16)11-14-3-8-22(9-4-14)13-17-19-7-10-24-17/h1-2,5-7,10,12,14H,3-4,8-9,11,13H2/p+1