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

Systemtic Name: 2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-[1-(4-butan-2-ylphenyl)propyl]ethanamide Openeye Name: 2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-[1-(4-sec-butylphenyl)propyl]acetamide CAS Name: 2-(4-bromo-3,5-dimethyl-1-pyrazolyl)-N-[1-(4-butan-2-ylphenyl)propyl]acetamide IUPAC Name: 2-(4-bromo-3,5-dimethylpyrazol-1-yl)-N-[1-(4-butan-2-ylphenyl)propyl]acetamide Traditional Name: 2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-[1-(4-sec-butylphenyl)propyl]acetamide Formula: C20H28BrN3O MolecularWeight: 406.35982

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)CN2C(=C(C(=N2)C)Br)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)CN2C(=C(C(=N2)C)Br)C

InChI

InChI=1S/C20H28BrN3O/c1-6-13(3)16-8-10-17(11-9-16)18(7-2)22-19(25)12-24-15(5)20(21)14(4)23-24/h8-11,13,18H,6-7,12H2,1-5H3,(H,22,25)