5-(1-adamantyl)-N'-(5-bromanyl-2-oxidanylidene-indol-3-yl)-1H-pyrazole-3-carbohydrazide

Systemtic Name: 5-(1-adamantyl)-N'-(5-bromanyl-2-oxidanylidene-indol-3-yl)-1H-pyrazole-3-carbohydrazide Openeye Name: 5-(1-adamantyl)-N'-(5-bromo-2-oxo-indol-3-yl)-1H-pyrazole-3-carbohydrazide CAS Name: 5-(1-adamantyl)-N'-(5-bromo-2-oxo-3-indolyl)-1H-pyrazole-3-carbohydrazide IUPAC Name: 5-(1-adamantyl)-N'-(5-bromo-2-oxoindol-3-yl)-1H-pyrazole-3-carbohydrazide Traditional Name: 5-(1-adamantyl)-N'-(5-bromo-2-keto-indol-3-yl)-1H-pyrazole-3-carbohydrazide Formula: C22H22BrN5O2 MolecularWeight: 468.34638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC(=NN4)C(=O)NNC5=C6C=C(C=CC6=NC5=O)Br

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC(=NN4)C(=O)NNC5=C6C=C(C=CC6=NC5=O)Br

InChI

InChI=1S/C22H22BrN5O2/c23-14-1-2-16-15(6-14)19(21(30)24-16)27-28-20(29)17-7-18(26-25-17)22-8-11-3-12(9-22)5-13(4-11)10-22/h1-2,6-7,11-13H,3-5,8-10H2,(H,25,26)(H,28,29)(H,24,27,30)