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

Systemtic Name: [4-azanyl-6-[(2-methylphenyl)amino]-1,3,5-triazin-2-yl]methyl 4-methyl-2-oxidanyl-benzoate Openeye Name: [4-amino-6-(2-methylanilino)-1,3,5-triazin-2-yl]methyl 2-hydroxy-4-methyl-benzoate CAS Name: 2-hydroxy-4-methylbenzoic 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-hydroxy-4-methylbenzoate Traditional Name: 2-hydroxy-4-methyl-benzoic acid [4-amino-6-(o-toluidino)-s-triazin-2-yl]methyl ester Formula: C19H19N5O3 MolecularWeight: 365.38586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3C)N)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3C)N)O

InChI

InChI=1S/C19H19N5O3/c1-11-7-8-13(15(25)9-11)17(26)27-10-16-22-18(20)24-19(23-16)21-14-6-4-3-5-12(14)2/h3-9,25H,10H2,1-2H3,(H3,20,21,22,23,24)