5-chloranyl-4-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methylamino]-1H-pyridazin-6-one

Systemtic Name: 5-chloranyl-4-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methylamino]-1H-pyridazin-6-one Openeye Name: 4-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methylamino]-5-chloro-1H-pyridazin-6-one CAS Name: 5-chloro-4-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methylamino]-1H-pyridazin-6-one IUPAC Name: 4-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methylamino]-5-chloro-1H-pyridazin-6-one Traditional Name: 4-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methylamino]-5-chloro-1H-pyridazin-6-one Formula: C17H18ClN5O MolecularWeight: 343.81072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC3=C(C(=O)NN=C3)Cl

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC3=C(C(=O)NN=C3)Cl

InChI

InChI=1S/C17H18ClN5O/c1-11-14(8-19-15-9-20-21-17(24)16(15)18)12(2)23(22-11)10-13-6-4-3-5-7-13/h3-7,9H,8,10H2,1-2H3,(H2,19,21,24)