6-[(2-chlorophenyl)methyl]-3-[(4-phenylazanylphenyl)amino]-2H-1,2,4-triazin-5-one

Systemtic Name: 6-[(2-chlorophenyl)methyl]-3-[(4-phenylazanylphenyl)amino]-2H-1,2,4-triazin-5-one Openeye Name: 3-(4-anilinoanilino)-6-[(2-chlorophenyl)methyl]-2H-1,2,4-triazin-5-one CAS Name: 3-(4-anilinoanilino)-6-[(2-chlorophenyl)methyl]-2H-1,2,4-triazin-5-one IUPAC Name: 3-(4-anilinoanilino)-6-[(2-chlorophenyl)methyl]-2H-1,2,4-triazin-5-one Traditional Name: 3-(4-anilinoanilino)-6-(2-chlorobenzyl)-2H-1,2,4-triazin-5-one Formula: C22H18ClN5O MolecularWeight: 403.86422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC3=NC(=O)C(=NN3)CC4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC3=NC(=O)C(=NN3)CC4=CC=CC=C4Cl

InChI

InChI=1S/C22H18ClN5O/c23-19-9-5-4-6-15(19)14-20-21(29)26-22(28-27-20)25-18-12-10-17(11-13-18)24-16-7-2-1-3-8-16/h1-13,24H,14H2,(H2,25,26,28,29)