5-[2,6-bis(chloranyl)pyridin-4-yl]-6-chloranyl-7-methyl-2-phenyl-1H-1,2,4-triazepin-3-one

Systemtic Name: 5-[2,6-bis(chloranyl)pyridin-4-yl]-6-chloranyl-7-methyl-2-phenyl-1H-1,2,4-triazepin-3-one Openeye Name: 6-chloro-5-(2,6-dichloro-4-pyridyl)-7-methyl-2-phenyl-1H-1,2,4-triazepin-3-one CAS Name: 6-chloro-5-(2,6-dichloro-4-pyridinyl)-7-methyl-2-phenyl-1H-1,2,4-triazepin-3-one IUPAC Name: 6-chloro-5-(2,6-dichloropyridin-4-yl)-7-methyl-2-phenyl-1H-1,2,4-triazepin-3-one Traditional Name: 6-chloro-5-(2,6-dichloro-4-pyridyl)-7-methyl-2-phenyl-1H-1,2,4-triazepin-3-one Formula: C16H11Cl3N4O MolecularWeight: 381.64374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N(N1)C2=CC=CC=C2)C3=CC(=NC(=C3)Cl)Cl)Cl

Isomeric SMILES

CC1=C(C(=NC(=O)N(N1)C2=CC=CC=C2)C3=CC(=NC(=C3)Cl)Cl)Cl

InChI

InChI=1S/C16H11Cl3N4O/c1-9-14(19)15(10-7-12(17)20-13(18)8-10)21-16(24)23(22-9)11-5-3-2-4-6-11/h2-8,22H,1H3