N-methyl-5-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]-N-[(1-methylpyrazol-4-yl)methyl]pyridin-1-ium-2-amine

Systemtic Name: N-methyl-5-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]-N-[(1-methylpyrazol-4-yl)methyl]pyridin-1-ium-2-amine Openeye Name: N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-5-[3-(o-tolyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-amine CAS Name: N-methyl-5-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]-N-[(1-methyl-4-pyrazolyl)methyl]-2-pyridin-1-iumamine IUPAC Name: N-methyl-5-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]-N-[(1-methylpyrazol-4-yl)methyl]pyridin-1-ium-2-amine Traditional Name: methyl-[(1-methylpyrazol-4-yl)methyl]-[5-[3-(o-tolyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-yl]amine Formula: C20H21N6O+ MolecularWeight: 361.42034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NOC(=N2)C3=C[NH+]=C(C=C3)N(C)CC4=CN(N=C4)C

Isomeric SMILES

CC1=CC=CC=C1C2=NOC(=N2)C3=C[NH+]=C(C=C3)N(C)CC4=CN(N=C4)C

InChI

InChI=1S/C20H20N6O/c1-14-6-4-5-7-17(14)19-23-20(27-24-19)16-8-9-18(21-11-16)25(2)12-15-10-22-26(3)13-15/h4-11,13H,12H2,1-3H3/p+1