4,5-dimethyl-2-(3-phenyl-5-pyridin-4-yl-1,2,3,4-tetrazol-2-ium-2-yl)-1,3-thiazole

Systemtic Name: 4,5-dimethyl-2-(3-phenyl-5-pyridin-4-yl-1,2,3,4-tetrazol-2-ium-2-yl)-1,3-thiazole Openeye Name: 4,5-dimethyl-2-[3-phenyl-5-(4-pyridyl)tetrazol-2-ium-2-yl]thiazole CAS Name: 4,5-dimethyl-2-(3-phenyl-5-pyridin-4-yl-2-tetrazol-2-iumyl)thiazole IUPAC Name: 4,5-dimethyl-2-(3-phenyl-5-pyridin-4-yltetrazol-2-ium-2-yl)-1,3-thiazole Traditional Name: 4,5-dimethyl-2-[3-phenyl-5-(4-pyridyl)tetrazol-2-ium-2-yl]thiazole Formula: C17H15N6S+ MolecularWeight: 335.4062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)[N+]2=NC(=NN2C3=CC=CC=C3)C4=CC=NC=C4)C

Isomeric SMILES

CC1=C(SC(=N1)[N+]2=NC(=NN2C3=CC=CC=C3)C4=CC=NC=C4)C

InChI

InChI=1S/C17H15N6S/c1-12-13(2)24-17(19-12)23-21-16(14-8-10-18-11-9-14)20-22(23)15-6-4-3-5-7-15/h3-11H,1-2H3/q+1