2,5-dimethyl-3-[4-[2-(1,2,4-triazol-1-yl)ethyl]piperazin-4-ium-1-yl]pyrazine

Systemtic Name: 2,5-dimethyl-3-[4-[2-(1,2,4-triazol-1-yl)ethyl]piperazin-4-ium-1-yl]pyrazine Openeye Name: 2,5-dimethyl-3-[4-[2-(1,2,4-triazol-1-yl)ethyl]piperazin-4-ium-1-yl]pyrazine CAS Name: 2,5-dimethyl-3-[4-[2-(1,2,4-triazol-1-yl)ethyl]-1-piperazin-4-iumyl]pyrazine IUPAC Name: 2,5-dimethyl-3-[4-[2-(1,2,4-triazol-1-yl)ethyl]piperazin-4-ium-1-yl]pyrazine Traditional Name: 2,5-dimethyl-3-[4-[2-(1,2,4-triazol-1-yl)ethyl]piperazin-4-ium-1-yl]pyrazine Formula: C14H22N7+ MolecularWeight: 288.37138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=N1)N2CC[NH+](CC2)CCN3C=NC=N3)C

Isomeric SMILES

CC1=CN=C(C(=N1)N2CC[NH+](CC2)CCN3C=NC=N3)C

InChI

InChI=1S/C14H21N7/c1-12-9-16-13(2)14(18-12)20-6-3-19(4-7-20)5-8-21-11-15-10-17-21/h9-11H,3-8H2,1-2H3/p+1