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

Systemtic Name: N-[3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-1,3-dimethyl-pyrazole-4-carboxamide Openeye Name: N-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-1,3-dimethyl-pyrazole-4-carboxamide CAS Name: N-[3-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]phenyl]-1,3-dimethyl-4-pyrazolecarboxamide IUPAC Name: N-[3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]phenyl]-1,3-dimethylpyrazole-4-carboxamide Traditional Name: N-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-1,3-dimethyl-pyrazole-4-carboxamide Formula: C18H20BrN5O MolecularWeight: 402.2883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC(=CC=C2)NC(=O)C3=CN(N=C3C)C)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC(=CC=C2)NC(=O)C3=CN(N=C3C)C)C)Br

InChI

InChI=1S/C18H20BrN5O/c1-11-16(10-23(4)21-11)18(25)20-15-7-5-6-14(8-15)9-24-13(3)17(19)12(2)22-24/h5-8,10H,9H2,1-4H3,(H,20,25)