2-[2-azanyl-6-(4-bromophenyl)-4-(2-chloranyl-7-methyl-quinolin-3-yl)pyridin-3-yl]ethanenitrile

Systemtic Name: 2-[2-azanyl-6-(4-bromophenyl)-4-(2-chloranyl-7-methyl-quinolin-3-yl)pyridin-3-yl]ethanenitrile Openeye Name: 2-[2-amino-6-(4-bromophenyl)-4-(2-chloro-7-methyl-3-quinolyl)-3-pyridyl]acetonitrile CAS Name: 2-[2-amino-6-(4-bromophenyl)-4-(2-chloro-7-methyl-3-quinolinyl)-3-pyridinyl]acetonitrile IUPAC Name: 2-[2-amino-6-(4-bromophenyl)-4-(2-chloro-7-methylquinolin-3-yl)pyridin-3-yl]acetonitrile Traditional Name: 2-[2-amino-6-(4-bromophenyl)-4-(2-chloro-7-methyl-3-quinolyl)-3-pyridyl]acetonitrile Formula: C23H16BrClN4 MolecularWeight: 463.75694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)C3=CC(=NC(=C3CC#N)N)C4=CC=C(C=C4)Br)Cl

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)C3=CC(=NC(=C3CC#N)N)C4=CC=C(C=C4)Br)Cl

InChI

InChI=1S/C23H16BrClN4/c1-13-2-3-15-11-19(22(25)28-20(15)10-13)18-12-21(14-4-6-16(24)7-5-14)29-23(27)17(18)8-9-26/h2-7,10-12H,8H2,1H3,(H2,27,29)