2-(4-bromanylpyrazol-1-yl)-N-[1-[(3-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]butanamide

Systemtic Name: 2-(4-bromanylpyrazol-1-yl)-N-[1-[(3-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]butanamide Openeye Name: 2-(4-bromopyrazol-1-yl)-N-[1-[(3-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]butanamide CAS Name: 2-(4-bromo-1-pyrazolyl)-N-[1-[(3-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]butanamide IUPAC Name: 2-(4-bromopyrazol-1-yl)-N-[1-[(3-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]butanamide Traditional Name: 2-(4-bromopyrazol-1-yl)-N-[1-(3-chlorobenzyl)-3,5-dimethyl-pyrazol-4-yl]butyramide Formula: C19H21BrClN5O MolecularWeight: 450.75994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(N(N=C1C)CC2=CC(=CC=C2)Cl)C)N3C=C(C=N3)Br

Isomeric SMILES

CCC(C(=O)NC1=C(N(N=C1C)CC2=CC(=CC=C2)Cl)C)N3C=C(C=N3)Br

InChI

InChI=1S/C19H21BrClN5O/c1-4-17(26-11-15(20)9-22-26)19(27)23-18-12(2)24-25(13(18)3)10-14-6-5-7-16(21)8-14/h5-9,11,17H,4,10H2,1-3H3,(H,23,27)