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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC(=C1)CN2C=C(C=N2)Br)N3C(=C(C(=N3)C)Cl)C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC(=C1)CN2C=C(C=N2)Br)N3C(=C(C(=N3)C)Cl)C

InChI

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