3-bromanyl-N-[4-(cyclohexylcarbamoyl)phenyl]-6-(1,2,4-triazol-4-yl)pyridine-2-carboxamide

Systemtic Name: 3-bromanyl-N-[4-(cyclohexylcarbamoyl)phenyl]-6-(1,2,4-triazol-4-yl)pyridine-2-carboxamide Openeye Name: 3-bromo-N-[4-(cyclohexylcarbamoyl)phenyl]-6-(1,2,4-triazol-4-yl)pyridine-2-carboxamide CAS Name: 3-bromo-N-[4-[(cyclohexylamino)-oxomethyl]phenyl]-6-(1,2,4-triazol-4-yl)-2-pyridinecarboxamide IUPAC Name: 3-bromo-N-[4-(cyclohexylcarbamoyl)phenyl]-6-(1,2,4-triazol-4-yl)pyridine-2-carboxamide Traditional Name: 3-bromo-N-[4-(cyclohexylcarbamoyl)phenyl]-6-(1,2,4-triazol-4-yl)picolinamide Formula: C21H21BrN6O2 MolecularWeight: 469.33444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=C(C=CC(=N3)N4C=NN=C4)Br

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=C(C=CC(=N3)N4C=NN=C4)Br

InChI

InChI=1S/C21H21BrN6O2/c22-17-10-11-18(28-12-23-24-13-28)27-19(17)21(30)26-16-8-6-14(7-9-16)20(29)25-15-4-2-1-3-5-15/h6-13,15H,1-5H2,(H,25,29)(H,26,30)