1-(2-bromophenyl)-1-[(2-chloranyl-4-methyl-phenyl)amino]-4-pyridin-3-yl-butan-2-one

Systemtic Name: 1-(2-bromophenyl)-1-[(2-chloranyl-4-methyl-phenyl)amino]-4-pyridin-3-yl-butan-2-one Openeye Name: 1-(2-bromophenyl)-1-(2-chloro-4-methyl-anilino)-4-(3-pyridyl)butan-2-one CAS Name: 1-(2-bromophenyl)-1-(2-chloro-4-methylanilino)-4-(3-pyridinyl)-2-butanone IUPAC Name: 1-(2-bromophenyl)-1-(2-chloro-4-methylanilino)-4-pyridin-3-ylbutan-2-one Traditional Name: 1-(2-bromophenyl)-1-(2-chloro-4-methyl-anilino)-4-(3-pyridyl)butan-2-one Formula: C22H20BrClN2O MolecularWeight: 443.764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(C2=CC=CC=C2Br)C(=O)CCC3=CN=CC=C3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)NC(C2=CC=CC=C2Br)C(=O)CCC3=CN=CC=C3)Cl

InChI

InChI=1S/C22H20BrClN2O/c1-15-8-10-20(19(24)13-15)26-22(17-6-2-3-7-18(17)23)21(27)11-9-16-5-4-12-25-14-16/h2-8,10,12-14,22,26H,9,11H2,1H3