[4-azanyl-6-[(2-ethylphenyl)amino]-1,3,5-triazin-2-yl]methyl (E)-3-quinolin-8-ylprop-2-enoate

Systemtic Name: [4-azanyl-6-[(2-ethylphenyl)amino]-1,3,5-triazin-2-yl]methyl (E)-3-quinolin-8-ylprop-2-enoate Openeye Name: [4-amino-6-(2-ethylanilino)-1,3,5-triazin-2-yl]methyl (E)-3-(8-quinolyl)prop-2-enoate CAS Name: (E)-3-(8-quinolinyl)-2-propenoic acid [4-amino-6-(2-ethylanilino)-1,3,5-triazin-2-yl]methyl ester IUPAC Name: [4-amino-6-(2-ethylanilino)-1,3,5-triazin-2-yl]methyl (E)-3-quinolin-8-ylprop-2-enoate Traditional Name: (E)-3-(8-quinolyl)acrylic acid [4-amino-6-(2-ethylanilino)-s-triazin-2-yl]methyl ester Formula: C24H22N6O2 MolecularWeight: 426.47048

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=NC(=NC(=N2)N)COC(=O)C=CC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CCC1=CC=CC=C1NC2=NC(=NC(=N2)N)COC(=O)/C=C/C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C24H22N6O2/c1-2-16-7-3-4-11-19(16)27-24-29-20(28-23(25)30-24)15-32-21(31)13-12-18-9-5-8-17-10-6-14-26-22(17)18/h3-14H,2,15H2,1H3,(H3,25,27,28,29,30)/b13-12+