(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 5-methyl-2-phenyl-1,2,3-triazole-4-carboxylate

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 5-methyl-2-phenyl-1,2,3-triazole-4-carboxylate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 5-methyl-2-phenyl-triazole-4-carboxylate CAS Name: 5-methyl-2-phenyl-4-triazolecarboxylic acid (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 5-methyl-2-phenyltriazole-4-carboxylate Traditional Name: 5-methyl-2-phenyl-triazole-4-carboxylic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C20H18N8O2 MolecularWeight: 402.40932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3)N)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(N=C1C(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3)N)C4=CC=CC=C4

InChI

InChI=1S/C20H18N8O2/c1-13-17(27-28(26-13)15-10-6-3-7-11-15)18(29)30-12-16-23-19(21)25-20(24-16)22-14-8-4-2-5-9-14/h2-11H,12H2,1H3,(H3,21,22,23,24,25)