(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 2-ethyl-4-methyl-quinoline-3-carboxylate

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 2-ethyl-4-methyl-quinoline-3-carboxylate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 2-ethyl-4-methyl-quinoline-3-carboxylate CAS Name: 2-ethyl-4-methyl-3-quinolinecarboxylic acid (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 2-ethyl-4-methylquinoline-3-carboxylate Traditional Name: 2-ethyl-4-methyl-quinoline-3-carboxylic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C23H22N6O2 MolecularWeight: 414.45978

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C(=O)OCC3=NC(=NC(=N3)NC4=CC=CC=C4)N)C

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C(=O)OCC3=NC(=NC(=N3)NC4=CC=CC=C4)N)C

InChI

InChI=1S/C23H22N6O2/c1-3-17-20(14(2)16-11-7-8-12-18(16)26-17)21(30)31-13-19-27-22(24)29-23(28-19)25-15-9-5-4-6-10-15/h4-12H,3,13H2,1-2H3,(H3,24,25,27,28,29)