3-phenyl-7-piperazin-4-ium-1-yl-[1,2,3]triazolo[4,5-d]pyrimidine

Systemtic Name: 3-phenyl-7-piperazin-4-ium-1-yl-[1,2,3]triazolo[4,5-d]pyrimidine Openeye Name: 3-phenyl-7-piperazin-4-ium-1-yl-triazolo[4,5-d]pyrimidine CAS Name: 3-phenyl-7-(1-piperazin-4-iumyl)triazolo[4,5-d]pyrimidine IUPAC Name: 3-phenyl-7-piperazin-4-ium-1-yltriazolo[4,5-d]pyrimidine Traditional Name: 3-phenyl-7-piperazin-4-ium-1-yl-triazolo[4,5-d]pyrimidine Formula: C14H16N7+ MolecularWeight: 282.32374

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=NC=NC3=C2N=NN3C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH2+]1)C2=NC=NC3=C2N=NN3C4=CC=CC=C4

InChI

InChI=1S/C14H15N7/c1-2-4-11(5-3-1)21-14-12(18-19-21)13(16-10-17-14)20-8-6-15-7-9-20/h1-5,10,15H,6-9H2/p+1