3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-2-methyl-N-[4-(piperidin-1-ylmethyl)phenyl]propanamide

Systemtic Name: 3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-2-methyl-N-[4-(piperidin-1-ylmethyl)phenyl]propanamide Openeye Name: 3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-2-methyl-N-[4-(1-piperidylmethyl)phenyl]propanamide CAS Name: 3-(4-bromo-3,5-dimethyl-1-pyrazolyl)-2-methyl-N-[4-(1-piperidinylmethyl)phenyl]propanamide IUPAC Name: 3-(4-bromo-3,5-dimethylpyrazol-1-yl)-2-methyl-N-[4-(piperidin-1-ylmethyl)phenyl]propanamide Traditional Name: 3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-2-methyl-N-[4-(piperidinomethyl)phenyl]propionamide Formula: C21H29BrN4O MolecularWeight: 433.38516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C(=O)NC2=CC=C(C=C2)CN3CCCCC3)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC(C)C(=O)NC2=CC=C(C=C2)CN3CCCCC3)C)Br

InChI

InChI=1S/C21H29BrN4O/c1-15(13-26-17(3)20(22)16(2)24-26)21(27)23-19-9-7-18(8-10-19)14-25-11-5-4-6-12-25/h7-10,15H,4-6,11-14H2,1-3H3,(H,23,27)