2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-[1-(4-butan-2-ylphenyl)propyl]propanamide

Systemtic Name: 2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-[1-(4-butan-2-ylphenyl)propyl]propanamide Openeye Name: 2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-[1-(4-sec-butylphenyl)propyl]propanamide CAS Name: 2-(4-bromo-3,5-dimethyl-1-pyrazolyl)-N-[1-(4-butan-2-ylphenyl)propyl]propanamide IUPAC Name: 2-(4-bromo-3,5-dimethylpyrazol-1-yl)-N-[1-(4-butan-2-ylphenyl)propyl]propanamide Traditional Name: 2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-[1-(4-sec-butylphenyl)propyl]propionamide Formula: C21H30BrN3O MolecularWeight: 420.3864

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)C(C)N2C(=C(C(=N2)C)Br)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)C(C)N2C(=C(C(=N2)C)Br)C

InChI

InChI=1S/C21H30BrN3O/c1-7-13(3)17-9-11-18(12-10-17)19(8-2)23-21(26)16(6)25-15(5)20(22)14(4)24-25/h9-13,16,19H,7-8H2,1-6H3,(H,23,26)