[4-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-[(3S)-3-methylpiperidin-1-yl]methanone

Systemtic Name: [4-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-[(3S)-3-methylpiperidin-1-yl]methanone Openeye Name: [4-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-[(3S)-3-methyl-1-piperidyl]methanone CAS Name: [4-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]phenyl]-[(3S)-3-methyl-1-piperidinyl]methanone IUPAC Name: [4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]phenyl]-[(3S)-3-methylpiperidin-1-yl]methanone Traditional Name: [4-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-[(3S)-3-methylpiperidino]methanone Formula: C19H24BrN3O MolecularWeight: 390.31736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2=CC=C(C=C2)CN3C(=C(C(=N3)C)Br)C

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)C2=CC=C(C=C2)CN3C(=C(C(=N3)C)Br)C

InChI

InChI=1S/C19H24BrN3O/c1-13-5-4-10-22(11-13)19(24)17-8-6-16(7-9-17)12-23-15(3)18(20)14(2)21-23/h6-9,13H,4-5,10-12H2,1-3H3/t13-/m0/s1