5-bromanyl-2-methoxy-N-[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl]benzamide

Systemtic Name: 5-bromanyl-2-methoxy-N-[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl]benzamide Openeye Name: 5-bromo-2-methoxy-N-[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl]benzamide CAS Name: 5-bromo-2-methoxy-N-[4-[(1,3,5-trimethyl-4-pyrazolyl)methyl]phenyl]benzamide IUPAC Name: 5-bromo-2-methoxy-N-[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl]benzamide Traditional Name: 5-bromo-2-methoxy-N-[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl]benzamide Formula: C21H22BrN3O2 MolecularWeight: 428.32228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)CC2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CC1=C(C(=NN1C)C)CC2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C21H22BrN3O2/c1-13-18(14(2)25(3)24-13)11-15-5-8-17(9-6-15)23-21(26)19-12-16(22)7-10-20(19)27-4/h5-10,12H,11H2,1-4H3,(H,23,26)