[4-azanyl-6-[(2-methylphenyl)amino]-1,3,5-triazin-2-yl]methyl (Z)-2-acetamido-3-phenyl-prop-2-enoate

Systemtic Name: [4-azanyl-6-[(2-methylphenyl)amino]-1,3,5-triazin-2-yl]methyl (Z)-2-acetamido-3-phenyl-prop-2-enoate Openeye Name: [4-amino-6-(2-methylanilino)-1,3,5-triazin-2-yl]methyl (Z)-2-acetamido-3-phenyl-prop-2-enoate CAS Name: (Z)-2-acetamido-3-phenyl-2-propenoic 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 (Z)-2-acetamido-3-phenylprop-2-enoate Traditional Name: (Z)-2-acetamido-3-phenyl-acrylic acid [4-amino-6-(o-toluidino)-s-triazin-2-yl]methyl ester Formula: C22H22N6O3 MolecularWeight: 418.44848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)COC(=O)C(=CC3=CC=CC=C3)NC(=O)C

Isomeric SMILES

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)COC(=O)/C(=C/C3=CC=CC=C3)/NC(=O)C

InChI

InChI=1S/C22H22N6O3/c1-14-8-6-7-11-17(14)25-22-27-19(26-21(23)28-22)13-31-20(30)18(24-15(2)29)12-16-9-4-3-5-10-16/h3-12H,13H2,1-2H3,(H,24,29)(H3,23,25,26,27,28)/b18-12-