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

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 1-ethylbenzotriazole-5-carboxylate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 1-ethylbenzotriazole-5-carboxylate CAS Name: 1-ethyl-5-benzotriazolecarboxylic 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-ethylbenzotriazole-5-carboxylate Traditional Name: 1-ethylbenzotriazole-5-carboxylic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C19H18N8O2 MolecularWeight: 390.39862

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC3=NC(=NC(=N3)NC4=CC=CC=C4)N)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC3=NC(=NC(=N3)NC4=CC=CC=C4)N)N=N1

InChI

InChI=1S/C19H18N8O2/c1-2-27-15-9-8-12(10-14(15)25-26-27)17(28)29-11-16-22-18(20)24-19(23-16)21-13-6-4-3-5-7-13/h3-10H,2,11H2,1H3,(H3,20,21,22,23,24)