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

Systemtic Name: [4-azanyl-6-[(4-methylphenyl)amino]-1,3,5-triazin-2-yl]methyl (E)-3-phenylprop-2-enoate Openeye Name: [4-amino-6-(4-methylanilino)-1,3,5-triazin-2-yl]methyl (E)-3-phenylprop-2-enoate CAS Name: (E)-3-phenyl-2-propenoic acid [4-amino-6-(4-methylanilino)-1,3,5-triazin-2-yl]methyl ester IUPAC Name: [4-amino-6-(4-methylanilino)-1,3,5-triazin-2-yl]methyl (E)-3-phenylprop-2-enoate Traditional Name: (E)-3-phenylacrylic acid [4-amino-6-(p-toluidino)-s-triazin-2-yl]methyl ester Formula: C20H19N5O2 MolecularWeight: 361.39716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C20H19N5O2/c1-14-7-10-16(11-8-14)22-20-24-17(23-19(21)25-20)13-27-18(26)12-9-15-5-3-2-4-6-15/h2-12H,13H2,1H3,(H3,21,22,23,24,25)/b12-9+