4-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylidene]-5-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: 4-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: 4-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C21H17ClN4O MolecularWeight: 376.83888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=C(N(N=C2C)C3=CC=CC=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=O)C1=CC2=C(N(N=C2C)C3=CC=CC=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C21H17ClN4O/c1-14-18(20(22)25(23-14)16-9-5-3-6-10-16)13-19-15(2)24-26(21(19)27)17-11-7-4-8-12-17/h3-13H,1-2H3