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

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 6-chloranylpyridine-3-carboxylate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 6-chloropyridine-3-carboxylate CAS Name: 6-chloro-3-pyridinecarboxylic 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 6-chloropyridine-3-carboxylate Traditional Name: 6-chloronicotinic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C16H13ClN6O2 MolecularWeight: 356.76642

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)C3=CN=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)C3=CN=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN6O2/c17-12-7-6-10(8-19-12)14(24)25-9-13-21-15(18)23-16(22-13)20-11-4-2-1-3-5-11/h1-8H,9H2,(H3,18,20,21,22,23)