N-(1-adamantylmethyl)-1-[(4-bromanylpyrazol-1-yl)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-1-[(4-bromanylpyrazol-1-yl)methyl]pyrazole-3-carboxamide Openeye Name: N-(1-adamantylmethyl)-1-[(4-bromopyrazol-1-yl)methyl]pyrazole-3-carboxamide CAS Name: N-(1-adamantylmethyl)-1-[(4-bromo-1-pyrazolyl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(1-adamantylmethyl)-1-[(4-bromopyrazol-1-yl)methyl]pyrazole-3-carboxamide Traditional Name: N-(1-adamantylmethyl)-1-[(4-bromopyrazol-1-yl)methyl]pyrazole-3-carboxamide Formula: C19H24BrN5O MolecularWeight: 418.33076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=NN(C=C4)CN5C=C(C=N5)Br

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=NN(C=C4)CN5C=C(C=N5)Br

InChI

InChI=1S/C19H24BrN5O/c20-16-9-22-25(10-16)12-24-2-1-17(23-24)18(26)21-11-19-6-13-3-14(7-19)5-15(4-13)8-19/h1-2,9-10,13-15H,3-8,11-12H2,(H,21,26)