2-[2-[(4-bromophenyl)amino]ethyl]-4-[(3-methoxyphenyl)methyl]-6-methyl-pyridazin-3-one

Systemtic Name: 2-[2-[(4-bromophenyl)amino]ethyl]-4-[(3-methoxyphenyl)methyl]-6-methyl-pyridazin-3-one Openeye Name: 2-[2-(4-bromoanilino)ethyl]-4-[(3-methoxyphenyl)methyl]-6-methyl-pyridazin-3-one CAS Name: 2-[2-(4-bromoanilino)ethyl]-4-[(3-methoxyphenyl)methyl]-6-methyl-3-pyridazinone IUPAC Name: 2-[2-(4-bromoanilino)ethyl]-4-[(3-methoxyphenyl)methyl]-6-methylpyridazin-3-one Traditional Name: 2-[2-(4-bromoanilino)ethyl]-4-m-anisyl-6-methyl-pyridazin-3-one Formula: C21H22BrN3O2 MolecularWeight: 428.32228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C(=C1)CC2=CC(=CC=C2)OC)CCNC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=NN(C(=O)C(=C1)CC2=CC(=CC=C2)OC)CCNC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H22BrN3O2/c1-15-12-17(13-16-4-3-5-20(14-16)27-2)21(26)25(24-15)11-10-23-19-8-6-18(22)7-9-19/h3-9,12,14,23H,10-11,13H2,1-2H3