5-naphthalen-2-yl-3-(4-pyridin-1-ium-4-ylpiperazin-1-yl)-1,2,4-triazine

Systemtic Name: 5-naphthalen-2-yl-3-(4-pyridin-1-ium-4-ylpiperazin-1-yl)-1,2,4-triazine Openeye Name: 5-(2-naphthyl)-3-(4-pyridin-1-ium-4-ylpiperazin-1-yl)-1,2,4-triazine CAS Name: 5-(2-naphthalenyl)-3-[4-(4-pyridin-1-iumyl)-1-piperazinyl]-1,2,4-triazine IUPAC Name: 5-naphthalen-2-yl-3-(4-pyridin-1-ium-4-ylpiperazin-1-yl)-1,2,4-triazine Traditional Name: 5-(2-naphthyl)-3-(4-pyridin-1-ium-4-ylpiperazino)-1,2,4-triazine Formula: C22H21N6+ MolecularWeight: 369.44234

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=[NH+]C=C2)C3=NC(=CN=N3)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CCN1C2=CC=[NH+]C=C2)C3=NC(=CN=N3)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C22H20N6/c1-2-4-18-15-19(6-5-17(18)3-1)21-16-24-26-22(25-21)28-13-11-27(12-14-28)20-7-9-23-10-8-20/h1-10,15-16H,11-14H2/p+1