6-[1-[5-(4-chlorophenyl)carbonyl-4-methyl-1H-pyrrol-2-yl]ethyl]-2-(phenylmethyl)pyridazin-3-one

Systemtic Name: 6-[1-[5-(4-chlorophenyl)carbonyl-4-methyl-1H-pyrrol-2-yl]ethyl]-2-(phenylmethyl)pyridazin-3-one Openeye Name: 2-benzyl-6-[1-[5-(4-chlorobenzoyl)-4-methyl-1H-pyrrol-2-yl]ethyl]pyridazin-3-one CAS Name: 6-[1-[5-[(4-chlorophenyl)-oxomethyl]-4-methyl-1H-pyrrol-2-yl]ethyl]-2-(phenylmethyl)-3-pyridazinone IUPAC Name: 2-benzyl-6-[1-[5-(4-chlorobenzoyl)-4-methyl-1H-pyrrol-2-yl]ethyl]pyridazin-3-one Traditional Name: 2-benzyl-6-[1-[5-(4-chlorobenzoyl)-4-methyl-1H-pyrrol-2-yl]ethyl]pyridazin-3-one Formula: C25H22ClN3O2 MolecularWeight: 431.91408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1)C(C)C2=NN(C(=O)C=C2)CC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(NC(=C1)C(C)C2=NN(C(=O)C=C2)CC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H22ClN3O2/c1-16-14-22(27-24(16)25(31)19-8-10-20(26)11-9-19)17(2)21-12-13-23(30)29(28-21)15-18-6-4-3-5-7-18/h3-14,17,27H,15H2,1-2H3