1-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[3-(morpholin-4-ylmethyl)phenyl]pyrazole-3-carboxamide

Systemtic Name: 1-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[3-(morpholin-4-ylmethyl)phenyl]pyrazole-3-carboxamide Openeye Name: 1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[3-(morpholinomethyl)phenyl]pyrazole-3-carboxamide CAS Name: 1-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-N-[3-(4-morpholinylmethyl)phenyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-[3-(morpholin-4-ylmethyl)phenyl]pyrazole-3-carboxamide Traditional Name: 1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[3-(morpholinomethyl)phenyl]pyrazole-3-carboxamide Formula: C21H25BrN6O2 MolecularWeight: 473.3662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)NC3=CC=CC(=C3)CN4CCOCC4)C)Br

Isomeric SMILES

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)NC3=CC=CC(=C3)CN4CCOCC4)C)Br

InChI

InChI=1S/C21H25BrN6O2/c1-15-20(22)16(2)28(24-15)14-27-7-6-19(25-27)21(29)23-18-5-3-4-17(12-18)13-26-8-10-30-11-9-26/h3-7,12H,8-11,13-14H2,1-2H3,(H,23,29)