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

Systemtic Name: N-[3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-2-(4-chloranylpyrazol-1-yl)butanamide Openeye Name: N-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-2-(4-chloropyrazol-1-yl)butanamide CAS Name: N-[3-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]phenyl]-2-(4-chloro-1-pyrazolyl)butanamide IUPAC Name: N-[3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]phenyl]-2-(4-chloropyrazol-1-yl)butanamide Traditional Name: N-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-2-(4-chloropyrazol-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)C)Br)C)N3C=C(C=N3)Cl

Isomeric SMILES

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

InChI

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