[4-[6-[(6-methylpyridin-1-ium-2-yl)amino]pyridazin-3-yl]piperazin-1-yl]-phenyl-methanone

Systemtic Name: [4-[6-[(6-methylpyridin-1-ium-2-yl)amino]pyridazin-3-yl]piperazin-1-yl]-phenyl-methanone Openeye Name: [4-[6-[(6-methylpyridin-1-ium-2-yl)amino]pyridazin-3-yl]piperazin-1-yl]-phenyl-methanone CAS Name: [4-[6-[(6-methyl-2-pyridin-1-iumyl)amino]-3-pyridazinyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-[6-[(6-methylpyridin-1-ium-2-yl)amino]pyridazin-3-yl]piperazin-1-yl]-phenylmethanone Traditional Name: [4-[6-[(6-methylpyridin-1-ium-2-yl)amino]pyridazin-3-yl]piperazino]-phenyl-methanone Formula: C21H23N6O+ MolecularWeight: 375.44692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C(=CC=C1)NC2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=[NH+]C(=CC=C1)NC2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H22N6O/c1-16-6-5-9-18(22-16)23-19-10-11-20(25-24-19)26-12-14-27(15-13-26)21(28)17-7-3-2-4-8-17/h2-11H,12-15H2,1H3,(H,22,23,24)/p+1