(4S)-4-(1H-pyrrol-3-yl)-4,10-dihydro-1H-[1,3,5]triazino[1,2-a]benzimidazol-5-ium-2-amine

Systemtic Name: (4S)-4-(1H-pyrrol-3-yl)-4,10-dihydro-1H-[1,3,5]triazino[1,2-a]benzimidazol-5-ium-2-amine Openeye Name: (4S)-4-(1H-pyrrol-3-yl)-4,10-dihydro-1H-[1,3,5]triazino[1,2-a]benzimidazol-5-ium-2-amine CAS Name: (4S)-4-(1H-pyrrol-3-yl)-4,10-dihydro-1H-[1,3,5]triazino[1,2-a]benzimidazol-5-ium-2-amine IUPAC Name: (4S)-4-(1H-pyrrol-3-yl)-4,10-dihydro-1H-[1,3,5]triazino[1,2-a]benzimidazol-5-ium-2-amine Traditional Name: [(4S)-4-(1H-pyrrol-3-yl)-4,10-dihydro-1H-[1,3,5]triazino[1,2-a]benzimidazol-5-ium-2-yl]amine Formula: C13H13N6+ MolecularWeight: 253.28252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC3=[N+]2C(N=C(N3)N)C4=CNC=C4

Isomeric SMILES

C1=CC=C2C(=C1)NC3=[N+]2[C@H](N=C(N3)N)C4=CNC=C4

InChI

InChI=1S/C13H12N6/c14-12-17-11(8-5-6-15-7-8)19-10-4-2-1-3-9(10)16-13(19)18-12/h1-7,11,15H,(H3,14,16,17,18)/p+1/t11-/m0/s1