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

Systemtic Name: [4-azanyl-6-[(2-methylphenyl)amino]-1,3,5-triazin-2-yl]methyl 4-ethoxybenzoate Openeye Name: [4-amino-6-(2-methylanilino)-1,3,5-triazin-2-yl]methyl 4-ethoxybenzoate CAS Name: 4-ethoxybenzoic 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 4-ethoxybenzoate Traditional Name: 4-ethoxybenzoic acid [4-amino-6-(o-toluidino)-s-triazin-2-yl]methyl ester Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3C)N

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3C)N

InChI

InChI=1S/C20H21N5O3/c1-3-27-15-10-8-14(9-11-15)18(26)28-12-17-23-19(21)25-20(24-17)22-16-7-5-4-6-13(16)2/h4-11H,3,12H2,1-2H3,(H3,21,22,23,24,25)