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

Systemtic Name: 3-[1-[5-(4-bromophenyl)carbonyl-4-methyl-1H-pyrrol-2-yl]ethyl]-1H-pyridazin-6-one Openeye Name: 3-[1-[5-(4-bromobenzoyl)-4-methyl-1H-pyrrol-2-yl]ethyl]-1H-pyridazin-6-one CAS Name: 3-[1-[5-[(4-bromophenyl)-oxomethyl]-4-methyl-1H-pyrrol-2-yl]ethyl]-1H-pyridazin-6-one IUPAC Name: 3-[1-[5-(4-bromobenzoyl)-4-methyl-1H-pyrrol-2-yl]ethyl]-1H-pyridazin-6-one Traditional Name: 3-[1-[5-(4-bromobenzoyl)-4-methyl-1H-pyrrol-2-yl]ethyl]-1H-pyridazin-6-one Formula: C18H16BrN3O2 MolecularWeight: 386.24254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1)C(C)C2=NNC(=O)C=C2)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(NC(=C1)C(C)C2=NNC(=O)C=C2)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H16BrN3O2/c1-10-9-15(11(2)14-7-8-16(23)22-21-14)20-17(10)18(24)12-3-5-13(19)6-4-12/h3-9,11,20H,1-2H3,(H,22,23)