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

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 1-methylindole-3-carboxylate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 1-methylindole-3-carboxylate CAS Name: 1-methyl-3-indolecarboxylic 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 1-methylindole-3-carboxylate Traditional Name: 1-methylindole-3-carboxylic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C20H18N6O2 MolecularWeight: 374.39592

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C(=O)OCC3=NC(=NC(=N3)NC4=CC=CC=C4)N

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C(=O)OCC3=NC(=NC(=N3)NC4=CC=CC=C4)N

InChI

InChI=1S/C20H18N6O2/c1-26-11-15(14-9-5-6-10-16(14)26)18(27)28-12-17-23-19(21)25-20(24-17)22-13-7-3-2-4-8-13/h2-11H,12H2,1H3,(H3,21,22,23,24,25)