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

Systemtic Name: (4R)-8-methyl-4-(4-methylphenyl)-2-[(4-methylphenyl)amino]-4,9-dihydro-1H-pyrimido[1,2-a][1,3,5]triazin-5-ium-6-one Openeye Name: (4R)-8-methyl-2-(4-methylanilino)-4-(p-tolyl)-4,9-dihydro-1H-pyrimido[1,2-a][1,3,5]triazin-5-ium-6-one CAS Name: (4R)-8-methyl-2-(4-methylanilino)-4-(4-methylphenyl)-4,9-dihydro-1H-pyrimido[1,2-a][1,3,5]triazin-5-ium-6-one IUPAC Name: (4R)-8-methyl-2-(4-methylanilino)-4-(4-methylphenyl)-4,9-dihydro-1H-pyrimido[1,2-a][1,3,5]triazin-5-ium-6-one Traditional Name: (4R)-8-methyl-2-(p-toluidino)-4-(p-tolyl)-4,9-dihydro-1H-pyrimido[1,2-a][1,3,5]triazin-5-ium-6-one Formula: C21H22N5O+ MolecularWeight: 360.43228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2N=C(NC3=[N+]2C(=O)C=C(N3)C)NC4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H]2N=C(NC3=[N+]2C(=O)C=C(N3)C)NC4=CC=C(C=C4)C

InChI

InChI=1S/C21H21N5O/c1-13-4-8-16(9-5-13)19-24-20(23-17-10-6-14(2)7-11-17)25-21-22-15(3)12-18(27)26(19)21/h4-12,19H,1-3H3,(H2,22,23,24,25,27)/p+1/t19-/m1/s1