N-[3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-4-[(4-tert-butylphenoxy)methyl]benzamide

Systemtic Name: N-[3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-4-[(4-tert-butylphenoxy)methyl]benzamide Openeye Name: N-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-4-[(4-tert-butylphenoxy)methyl]benzamide CAS Name: N-[3-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]phenyl]-4-[(4-tert-butylphenoxy)methyl]benzamide IUPAC Name: N-[3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]phenyl]-4-[(4-tert-butylphenoxy)methyl]benzamide Traditional Name: N-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-4-[(4-tert-butylphenoxy)methyl]benzamide Formula: C30H32BrN3O2 MolecularWeight: 546.49798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)COC4=CC=C(C=C4)C(C)(C)C)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)COC4=CC=C(C=C4)C(C)(C)C)C)Br

InChI

InChI=1S/C30H32BrN3O2/c1-20-28(31)21(2)34(33-20)18-23-7-6-8-26(17-23)32-29(35)24-11-9-22(10-12-24)19-36-27-15-13-25(14-16-27)30(3,4)5/h6-17H,18-19H2,1-5H3,(H,32,35)