5-bromanyl-4-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-pyridazin-3-one

Systemtic Name: 5-bromanyl-4-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-pyridazin-3-one Openeye Name: 5-bromo-4-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-pyridazin-3-one CAS Name: 5-bromo-4-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)thio]-2-phenyl-3-pyridazinone IUPAC Name: 5-bromo-4-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenylpyridazin-3-one Traditional Name: 5-bromo-4-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)thio]-2-phenyl-pyridazin-3-one Formula: C24H22BrN5OS MolecularWeight: 508.43338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=C2SC3=C(C=NN(C3=O)C4=CC=CC=C4)Br)C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)N2C(=NN=C2SC3=C(C=NN(C3=O)C4=CC=CC=C4)Br)C5=CC=CC=C5

InChI

InChI=1S/C24H22BrN5OS/c25-20-16-26-30(19-14-8-3-9-15-19)23(31)21(20)32-24-28-27-22(17-10-4-1-5-11-17)29(24)18-12-6-2-7-13-18/h1,3-5,8-11,14-16,18H,2,6-7,12-13H2