2-bromanyl-3-methyl-N-[(1-phenylpyrazol-4-yl)methyl]butanamide

Systemtic Name: 2-bromanyl-3-methyl-N-[(1-phenylpyrazol-4-yl)methyl]butanamide Openeye Name: 2-bromo-3-methyl-N-[(1-phenylpyrazol-4-yl)methyl]butanamide CAS Name: 2-bromo-3-methyl-N-[(1-phenyl-4-pyrazolyl)methyl]butanamide IUPAC Name: 2-bromo-3-methyl-N-[(1-phenylpyrazol-4-yl)methyl]butanamide Traditional Name: 2-bromo-3-methyl-N-[(1-phenylpyrazol-4-yl)methyl]butyramide Formula: C15H18BrN3O MolecularWeight: 336.22692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CN(N=C1)C2=CC=CC=C2)Br

Isomeric SMILES

CC(C)C(C(=O)NCC1=CN(N=C1)C2=CC=CC=C2)Br

InChI

InChI=1S/C15H18BrN3O/c1-11(2)14(16)15(20)17-8-12-9-18-19(10-12)13-6-4-3-5-7-13/h3-7,9-11,14H,8H2,1-2H3,(H,17,20)