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

Systemtic Name: 6-[(4-chlorophenyl)methyl]-3-[(2-methyl-4-nitro-phenyl)amino]-2H-1,2,4-triazin-5-one Openeye Name: 6-[(4-chlorophenyl)methyl]-3-(2-methyl-4-nitro-anilino)-2H-1,2,4-triazin-5-one CAS Name: 6-[(4-chlorophenyl)methyl]-3-(2-methyl-4-nitroanilino)-2H-1,2,4-triazin-5-one IUPAC Name: 6-[(4-chlorophenyl)methyl]-3-(2-methyl-4-nitroanilino)-2H-1,2,4-triazin-5-one Traditional Name: 6-(4-chlorobenzyl)-3-(2-methyl-4-nitro-anilino)-2H-1,2,4-triazin-5-one Formula: C17H14ClN5O3 MolecularWeight: 371.77776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC2=NC(=O)C(=NN2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC2=NC(=O)C(=NN2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H14ClN5O3/c1-10-8-13(23(25)26)6-7-14(10)19-17-20-16(24)15(21-22-17)9-11-2-4-12(18)5-3-11/h2-8H,9H2,1H3,(H2,19,20,22,24)