N-(4-bromanyl-2-methyl-phenyl)-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(4-bromo-2-methyl-phenyl)pyrazole-4-carboxamide CAS Name: N-(4-bromo-2-methylphenyl)-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-(4-bromo-2-methylphenyl)pyrazole-4-carboxamide Traditional Name: 1-benzyl-N-(4-bromo-2-methyl-phenyl)pyrazole-4-carboxamide Formula: C18H16BrN3O MolecularWeight: 370.24314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C2=CN(N=C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C2=CN(N=C2)CC3=CC=CC=C3

InChI

InChI=1S/C18H16BrN3O/c1-13-9-16(19)7-8-17(13)21-18(23)15-10-20-22(12-15)11-14-5-3-2-4-6-14/h2-10,12H,11H2,1H3,(H,21,23)