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

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 1-ethylindole-3-carboxylate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 1-ethylindole-3-carboxylate CAS Name: 1-ethyl-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-ethylindole-3-carboxylate Traditional Name: 1-ethylindole-3-carboxylic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C21H20N6O2 MolecularWeight: 388.4225

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=CC=CC=C21)C(=O)OCC3=NC(=NC(=N3)NC4=CC=CC=C4)N

Isomeric SMILES

CCN1C=C(C2=CC=CC=C21)C(=O)OCC3=NC(=NC(=N3)NC4=CC=CC=C4)N

InChI

InChI=1S/C21H20N6O2/c1-2-27-12-16(15-10-6-7-11-17(15)27)19(28)29-13-18-24-20(22)26-21(25-18)23-14-8-4-3-5-9-14/h3-12H,2,13H2,1H3,(H3,22,23,24,25,26)