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

Systemtic Name: [4-azanyl-6-[(2-methoxyphenyl)amino]-1,3,5-triazin-2-yl]methyl 4-benzamidobutanoate Openeye Name: [4-amino-6-(2-methoxyanilino)-1,3,5-triazin-2-yl]methyl 4-benzamidobutanoate CAS Name: 4-benzamidobutanoic acid [4-amino-6-(2-methoxyanilino)-1,3,5-triazin-2-yl]methyl ester IUPAC Name: [4-amino-6-(2-methoxyanilino)-1,3,5-triazin-2-yl]methyl 4-benzamidobutanoate Traditional Name: 4-benzamidobutyric acid [4-amino-6-(o-anisidino)-s-triazin-2-yl]methyl ester Formula: C22H24N6O4 MolecularWeight: 436.46376

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC2=NC(=NC(=N2)N)COC(=O)CCCNC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1NC2=NC(=NC(=N2)N)COC(=O)CCCNC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H24N6O4/c1-31-17-11-6-5-10-16(17)25-22-27-18(26-21(23)28-22)14-32-19(29)12-7-13-24-20(30)15-8-3-2-4-9-15/h2-6,8-11H,7,12-14H2,1H3,(H,24,30)(H3,23,25,26,27,28)