N-[4-bromanyl-5-(4-phenylpiperazin-1-yl)carbonyl-1H-pyrazol-3-yl]-2-chloranyl-benzamide

Systemtic Name: N-[4-bromanyl-5-(4-phenylpiperazin-1-yl)carbonyl-1H-pyrazol-3-yl]-2-chloranyl-benzamide Openeye Name: N-[4-bromo-5-(4-phenylpiperazine-1-carbonyl)-1H-pyrazol-3-yl]-2-chloro-benzamide CAS Name: N-[4-bromo-5-[oxo-(4-phenyl-1-piperazinyl)methyl]-1H-pyrazol-3-yl]-2-chlorobenzamide IUPAC Name: N-[4-bromo-5-(4-phenylpiperazine-1-carbonyl)-1H-pyrazol-3-yl]-2-chlorobenzamide Traditional Name: N-[4-bromo-5-(4-phenylpiperazine-1-carbonyl)-1H-pyrazol-3-yl]-2-chloro-benzamide Formula: C21H19BrClN5O2 MolecularWeight: 488.76486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=C(C(=NN3)NC(=O)C4=CC=CC=C4Cl)Br

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=C(C(=NN3)NC(=O)C4=CC=CC=C4Cl)Br

InChI

InChI=1S/C21H19BrClN5O2/c22-17-18(25-26-19(17)24-20(29)15-8-4-5-9-16(15)23)21(30)28-12-10-27(11-13-28)14-6-2-1-3-7-14/h1-9H,10-13H2,(H2,24,25,26,29)