(4R)-8-methyl-2-piperidin-1-yl-4-pyridin-3-yl-4,9-dihydro-1H-pyrimido[1,2-a][1,3,5]triazin-5-ium-6-one

Systemtic Name: (4R)-8-methyl-2-piperidin-1-yl-4-pyridin-3-yl-4,9-dihydro-1H-pyrimido[1,2-a][1,3,5]triazin-5-ium-6-one Openeye Name: (4R)-8-methyl-2-(1-piperidyl)-4-(3-pyridyl)-4,9-dihydro-1H-pyrimido[1,2-a][1,3,5]triazin-5-ium-6-one CAS Name: (4R)-8-methyl-2-(1-piperidinyl)-4-(3-pyridinyl)-4,9-dihydro-1H-pyrimido[1,2-a][1,3,5]triazin-5-ium-6-one IUPAC Name: (4R)-8-methyl-2-piperidin-1-yl-4-pyridin-3-yl-4,9-dihydro-1H-pyrimido[1,2-a][1,3,5]triazin-5-ium-6-one Traditional Name: (4R)-8-methyl-2-piperidino-4-(3-pyridyl)-4,9-dihydro-1H-pyrimido[1,2-a][1,3,5]triazin-5-ium-6-one Formula: C17H21N6O+ MolecularWeight: 325.38824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)[N+]2=C(N1)NC(=NC2C3=CN=CC=C3)N4CCCCC4

Isomeric SMILES

CC1=CC(=O)[N+]2=C(N1)NC(=N[C@H]2C3=CN=CC=C3)N4CCCCC4

InChI

InChI=1S/C17H20N6O/c1-12-10-14(24)23-15(13-6-5-7-18-11-13)20-16(21-17(23)19-12)22-8-3-2-4-9-22/h5-7,10-11,15H,2-4,8-9H2,1H3,(H,19,20,21,24)/p+1/t15-/m1/s1