1,5,7-trimethyl-N-phenyl-[1,2,4]triazolo[4,3-c]pyrimidin-4-ium-3-amine

Systemtic Name: 1,5,7-trimethyl-N-phenyl-[1,2,4]triazolo[4,3-c]pyrimidin-4-ium-3-amine Openeye Name: 1,5,7-trimethyl-N-phenyl-[1,2,4]triazolo[4,3-c]pyrimidin-4-ium-3-amine CAS Name: 1,5,7-trimethyl-N-phenyl-[1,2,4]triazolo[4,3-c]pyrimidin-4-ium-3-amine IUPAC Name: 1,5,7-trimethyl-N-phenyl-[1,2,4]triazolo[4,3-c]pyrimidin-4-ium-3-amine Traditional Name: phenyl-(1,5,7-trimethyl-[1,2,4]triazolo[4,3-c]pyrimidin-4-ium-3-yl)amine Formula: C14H16N5+ MolecularWeight: 254.31034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=[N+](C(=N1)C)C(=NN2C)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC2=[N+](C(=N1)C)C(=NN2C)NC3=CC=CC=C3

InChI

InChI=1S/C14H16N5/c1-10-9-13-18(3)17-14(19(13)11(2)15-10)16-12-7-5-4-6-8-12/h4-9H,1-3H3,(H,16,17)/q+1