4-[(3-chlorophenyl)amino]-2-(cyclopropylmethyl)-5-ethanoyl-6-phenyl-pyridazin-3-one

Systemtic Name: 4-[(3-chlorophenyl)amino]-2-(cyclopropylmethyl)-5-ethanoyl-6-phenyl-pyridazin-3-one Openeye Name: 5-acetyl-4-(3-chloroanilino)-2-(cyclopropylmethyl)-6-phenyl-pyridazin-3-one CAS Name: 5-acetyl-4-(3-chloroanilino)-2-(cyclopropylmethyl)-6-phenyl-3-pyridazinone IUPAC Name: 5-acetyl-4-(3-chloroanilino)-2-(cyclopropylmethyl)-6-phenylpyridazin-3-one Traditional Name: 5-acetyl-4-(3-chloroanilino)-2-(cyclopropylmethyl)-6-phenyl-pyridazin-3-one Formula: C22H20ClN3O2 MolecularWeight: 393.8661

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=O)N(N=C1C2=CC=CC=C2)CC3CC3)NC4=CC(=CC=C4)Cl

Isomeric SMILES

CC(=O)C1=C(C(=O)N(N=C1C2=CC=CC=C2)CC3CC3)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H20ClN3O2/c1-14(27)19-20(16-6-3-2-4-7-16)25-26(13-15-10-11-15)22(28)21(19)24-18-9-5-8-17(23)12-18/h2-9,12,15,24H,10-11,13H2,1H3