2-[3,5-bis(chloranyl)-4-[(6-oxidanylidene-5-propan-2-yl-1H-pyridazin-3-yl)methyl]phenyl]-1,2,4-triazine-3,5-dione

Systemtic Name: 2-[3,5-bis(chloranyl)-4-[(6-oxidanylidene-5-propan-2-yl-1H-pyridazin-3-yl)methyl]phenyl]-1,2,4-triazine-3,5-dione Openeye Name: 2-[3,5-dichloro-4-[(5-isopropyl-6-oxo-1H-pyridazin-3-yl)methyl]phenyl]-1,2,4-triazine-3,5-dione CAS Name: 2-[3,5-dichloro-4-[(6-oxo-5-propan-2-yl-1H-pyridazin-3-yl)methyl]phenyl]-1,2,4-triazine-3,5-dione IUPAC Name: 2-[3,5-dichloro-4-[(6-oxo-5-propan-2-yl-1H-pyridazin-3-yl)methyl]phenyl]-1,2,4-triazine-3,5-dione Traditional Name: 2-[3,5-dichloro-4-[(5-isopropyl-6-keto-1H-pyridazin-3-yl)methyl]phenyl]-1,2,4-triazine-3,5-quinone Formula: C17H15Cl2N5O3 MolecularWeight: 408.2387

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=NNC1=O)CC2=C(C=C(C=C2Cl)N3C(=O)NC(=O)C=N3)Cl

Isomeric SMILES

CC(C)C1=CC(=NNC1=O)CC2=C(C=C(C=C2Cl)N3C(=O)NC(=O)C=N3)Cl

InChI

InChI=1S/C17H15Cl2N5O3/c1-8(2)11-3-9(22-23-16(11)26)4-12-13(18)5-10(6-14(12)19)24-17(27)21-15(25)7-20-24/h3,5-8H,4H2,1-2H3,(H,23,26)(H,21,25,27)