4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-[1-(phenylmethyl)piperidin-4-yl]benzamide

Systemtic Name: 4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-[1-(phenylmethyl)piperidin-4-yl]benzamide Openeye Name: N-(1-benzyl-4-piperidyl)-4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)benzamide CAS Name: 4-(4-bromo-3,5-dimethyl-1-pyrazolyl)-N-[1-(phenylmethyl)-4-piperidinyl]benzamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-4-(4-bromo-3,5-dimethylpyrazol-1-yl)benzamide Traditional Name: N-(1-benzyl-4-piperidyl)-4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)benzamide Formula: C24H27BrN4O MolecularWeight: 467.40138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NC3CCN(CC3)CC4=CC=CC=C4)C)Br

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NC3CCN(CC3)CC4=CC=CC=C4)C)Br

InChI

InChI=1S/C24H27BrN4O/c1-17-23(25)18(2)29(27-17)22-10-8-20(9-11-22)24(30)26-21-12-14-28(15-13-21)16-19-6-4-3-5-7-19/h3-11,21H,12-16H2,1-2H3,(H,26,30)