N-(2-bromanyl-4-methyl-phenyl)-4-pyrazol-1-yl-benzamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-4-pyrazol-1-yl-benzamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-4-pyrazol-1-yl-benzamide CAS Name: N-(2-bromo-4-methylphenyl)-4-(1-pyrazolyl)benzamide IUPAC Name: N-(2-bromo-4-methylphenyl)-4-pyrazol-1-ylbenzamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-4-pyrazol-1-yl-benzamide Formula: C17H14BrN3O MolecularWeight: 356.21656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=CC=C(C=C2)N3C=CC=N3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=CC=C(C=C2)N3C=CC=N3)Br

InChI

InChI=1S/C17H14BrN3O/c1-12-3-8-16(15(18)11-12)20-17(22)13-4-6-14(7-5-13)21-10-2-9-19-21/h2-11H,1H3,(H,20,22)