7-bromanyl-4-[(2-fluoranyl-4-methyl-phenyl)amino]cinnoline-3-carboxamide

Systemtic Name: 7-bromanyl-4-[(2-fluoranyl-4-methyl-phenyl)amino]cinnoline-3-carboxamide Openeye Name: 7-bromo-4-(2-fluoro-4-methyl-anilino)cinnoline-3-carboxamide CAS Name: 7-bromo-4-(2-fluoro-4-methylanilino)-3-cinnolinecarboxamide IUPAC Name: 7-bromo-4-(2-fluoro-4-methylanilino)cinnoline-3-carboxamide Traditional Name: 7-bromo-4-(2-fluoro-4-methyl-anilino)cinnoline-3-carboxamide Formula: C16H12BrFN4O MolecularWeight: 375.195083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=C(N=NC3=C2C=CC(=C3)Br)C(=O)N)F

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=C(N=NC3=C2C=CC(=C3)Br)C(=O)N)F

InChI

InChI=1S/C16H12BrFN4O/c1-8-2-5-12(11(18)6-8)20-14-10-4-3-9(17)7-13(10)21-22-15(14)16(19)23/h2-7H,1H3,(H2,19,23)(H,20,21)