N-[4-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-5-methyl-1,3-diphenyl-pyrazole-4-carboxamide

Systemtic Name: N-[4-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-5-methyl-1,3-diphenyl-pyrazole-4-carboxamide Openeye Name: N-[4-[(4-bromopyrazol-1-yl)methyl]phenyl]-5-methyl-1,3-diphenyl-pyrazole-4-carboxamide CAS Name: N-[4-[(4-bromo-1-pyrazolyl)methyl]phenyl]-5-methyl-1,3-diphenyl-4-pyrazolecarboxamide IUPAC Name: N-[4-[(4-bromopyrazol-1-yl)methyl]phenyl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide Traditional Name: N-[4-[(4-bromopyrazol-1-yl)methyl]phenyl]-5-methyl-1,3-diphenyl-pyrazole-4-carboxamide Formula: C27H22BrN5O MolecularWeight: 512.40048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)CN5C=C(C=N5)Br

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)CN5C=C(C=N5)Br

InChI

InChI=1S/C27H22BrN5O/c1-19-25(26(21-8-4-2-5-9-21)31-33(19)24-10-6-3-7-11-24)27(34)30-23-14-12-20(13-15-23)17-32-18-22(28)16-29-32/h2-16,18H,17H2,1H3,(H,30,34)