2-[[(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)-methyl-amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)-methyl-amino]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[(5-chloro-6-oxo-1-phenyl-pyridazin-4-yl)-methyl-amino]methyl]-1H-quinazolin-4-one CAS Name: 2-[[(5-chloro-6-oxo-1-phenyl-4-pyridazinyl)-methylamino]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[(5-chloro-6-oxo-1-phenylpyridazin-4-yl)-methylamino]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[(5-chloro-6-keto-1-phenyl-pyridazin-4-yl)-methyl-amino]methyl]-1H-quinazolin-4-one Formula: C20H16ClN5O2 MolecularWeight: 393.82634

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC(=O)C2=CC=CC=C2N1)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

CN(CC1=NC(=O)C2=CC=CC=C2N1)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C20H16ClN5O2/c1-25(12-17-23-15-10-6-5-9-14(15)19(27)24-17)16-11-22-26(20(28)18(16)21)13-7-3-2-4-8-13/h2-11H,12H2,1H3,(H,23,24,27)