[4-azanyl-6-[(2-methylphenyl)amino]-1,3,5-triazin-2-yl]methyl 2-ethoxypyridine-3-carboxylate

Systemtic Name: [4-azanyl-6-[(2-methylphenyl)amino]-1,3,5-triazin-2-yl]methyl 2-ethoxypyridine-3-carboxylate Openeye Name: [4-amino-6-(2-methylanilino)-1,3,5-triazin-2-yl]methyl 2-ethoxypyridine-3-carboxylate CAS Name: 2-ethoxy-3-pyridinecarboxylic acid [4-amino-6-(2-methylanilino)-1,3,5-triazin-2-yl]methyl ester IUPAC Name: [4-amino-6-(2-methylanilino)-1,3,5-triazin-2-yl]methyl 2-ethoxypyridine-3-carboxylate Traditional Name: 2-ethoxynicotinic acid [4-amino-6-(o-toluidino)-s-triazin-2-yl]methyl ester Formula: C19H20N6O3 MolecularWeight: 380.4005

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)C(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3C)N

Isomeric SMILES

CCOC1=C(C=CC=N1)C(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3C)N

InChI

InChI=1S/C19H20N6O3/c1-3-27-16-13(8-6-10-21-16)17(26)28-11-15-23-18(20)25-19(24-15)22-14-9-5-4-7-12(14)2/h4-10H,3,11H2,1-2H3,(H3,20,22,23,24,25)