N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide

Systemtic Name: N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide Openeye Name: N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-6-oxo-1-propyl-pyridazine-3-carboxamide CAS Name: N-[[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]methyl]-N-methyl-6-oxo-1-propyl-3-pyridazinecarboxamide IUPAC Name: N-[[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]methyl]-N-methyl-6-oxo-1-propylpyridazine-3-carboxamide Traditional Name: N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-6-keto-N-methyl-1-propyl-pyridazine-3-carboxamide Formula: C25H24ClN5O2 MolecularWeight: 461.94336

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)N(C)CC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)N(C)CC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C25H24ClN5O2/c1-3-15-30-23(32)14-13-22(27-30)25(33)29(2)16-19-17-31(21-7-5-4-6-8-21)28-24(19)18-9-11-20(26)12-10-18/h4-14,17H,3,15-16H2,1-2H3