5-(4-methoxyphenyl)-3-[4-(6-methylpyridin-1-ium-2-yl)piperazin-1-yl]-1,2,4-triazine

Systemtic Name: 5-(4-methoxyphenyl)-3-[4-(6-methylpyridin-1-ium-2-yl)piperazin-1-yl]-1,2,4-triazine Openeye Name: 5-(4-methoxyphenyl)-3-[4-(6-methylpyridin-1-ium-2-yl)piperazin-1-yl]-1,2,4-triazine CAS Name: 5-(4-methoxyphenyl)-3-[4-(6-methyl-2-pyridin-1-iumyl)-1-piperazinyl]-1,2,4-triazine IUPAC Name: 5-(4-methoxyphenyl)-3-[4-(6-methylpyridin-1-ium-2-yl)piperazin-1-yl]-1,2,4-triazine Traditional Name: 5-(4-methoxyphenyl)-3-[4-(6-methylpyridin-1-ium-2-yl)piperazino]-1,2,4-triazine Formula: C20H23N6O+ MolecularWeight: 363.43622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C(=CC=C1)N2CCN(CC2)C3=NC(=CN=N3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=[NH+]C(=CC=C1)N2CCN(CC2)C3=NC(=CN=N3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C20H22N6O/c1-15-4-3-5-19(22-15)25-10-12-26(13-11-25)20-23-18(14-21-24-20)16-6-8-17(27-2)9-7-16/h3-9,14H,10-13H2,1-2H3/p+1