N-[3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-2,5-dimethyl-pyrazole-3-carboxamide

Systemtic Name: N-[3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-2,5-dimethyl-pyrazole-3-carboxamide Openeye Name: N-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-2,5-dimethyl-pyrazole-3-carboxamide CAS Name: N-[3-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]phenyl]-2,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-[3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]phenyl]-2,5-dimethylpyrazole-3-carboxamide Traditional Name: N-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-2,5-dimethyl-pyrazole-3-carboxamide Formula: C18H20BrN5O MolecularWeight: 402.2883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)NC2=CC=CC(=C2)CN3C(=C(C(=N3)C)Br)C)C

Isomeric SMILES

CC1=NN(C(=C1)C(=O)NC2=CC=CC(=C2)CN3C(=C(C(=N3)C)Br)C)C

InChI

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