2-(4-bromanylpyrazol-1-yl)-N-[4-chloranyl-1-(phenylmethyl)pyrazol-3-yl]butanamide

Systemtic Name: 2-(4-bromanylpyrazol-1-yl)-N-[4-chloranyl-1-(phenylmethyl)pyrazol-3-yl]butanamide Openeye Name: N-(1-benzyl-4-chloro-pyrazol-3-yl)-2-(4-bromopyrazol-1-yl)butanamide CAS Name: 2-(4-bromo-1-pyrazolyl)-N-[4-chloro-1-(phenylmethyl)-3-pyrazolyl]butanamide IUPAC Name: N-(1-benzyl-4-chloropyrazol-3-yl)-2-(4-bromopyrazol-1-yl)butanamide Traditional Name: N-(1-benzyl-4-chloro-pyrazol-3-yl)-2-(4-bromopyrazol-1-yl)butyramide Formula: C17H17BrClN5O MolecularWeight: 422.70678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NN(C=C1Cl)CC2=CC=CC=C2)N3C=C(C=N3)Br

Isomeric SMILES

CCC(C(=O)NC1=NN(C=C1Cl)CC2=CC=CC=C2)N3C=C(C=N3)Br

InChI

InChI=1S/C17H17BrClN5O/c1-2-15(24-10-13(18)8-20-24)17(25)21-16-14(19)11-23(22-16)9-12-6-4-3-5-7-12/h3-8,10-11,15H,2,9H2,1H3,(H,21,22,25)