N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N-methyl-3-(1-phenylpyrazol-4-yl)propanamide

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N-methyl-3-(1-phenylpyrazol-4-yl)propanamide Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-N-methyl-3-(1-phenylpyrazol-4-yl)propanamide CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-N-methyl-3-(1-phenyl-4-pyrazolyl)propanamide IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-N-methyl-3-(1-phenylpyrazol-4-yl)propanamide Traditional Name: N-(5-bromo-2-methoxy-benzyl)-N-methyl-3-(1-phenylpyrazol-4-yl)propionamide Formula: C21H22BrN3O2 MolecularWeight: 428.32228

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)Br)OC)C(=O)CCC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CN(CC1=C(C=CC(=C1)Br)OC)C(=O)CCC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H22BrN3O2/c1-24(15-17-12-18(22)9-10-20(17)27-2)21(26)11-8-16-13-23-25(14-16)19-6-4-3-5-7-19/h3-7,9-10,12-14H,8,11,15H2,1-2H3