2-[4-(4-bromanyl-2-ethyl-5-methyl-pyrazol-3-yl)carbonyl-1,4-diazepan-1-yl]-N-(2,6-diethylphenyl)ethanamide

Systemtic Name: 2-[4-(4-bromanyl-2-ethyl-5-methyl-pyrazol-3-yl)carbonyl-1,4-diazepan-1-yl]-N-(2,6-diethylphenyl)ethanamide Openeye Name: 2-[4-(4-bromo-2-ethyl-5-methyl-pyrazole-3-carbonyl)-1,4-diazepan-1-yl]-N-(2,6-diethylphenyl)acetamide CAS Name: 2-[4-[(4-bromo-2-ethyl-5-methyl-3-pyrazolyl)-oxomethyl]-1,4-diazepan-1-yl]-N-(2,6-diethylphenyl)acetamide IUPAC Name: 2-[4-(4-bromo-2-ethyl-5-methylpyrazole-3-carbonyl)-1,4-diazepan-1-yl]-N-(2,6-diethylphenyl)acetamide Traditional Name: 2-[4-(4-bromo-2-ethyl-5-methyl-pyrazole-3-carbonyl)-1,4-diazepan-1-yl]-N-(2,6-diethylphenyl)acetamide Formula: C24H34BrN5O2 MolecularWeight: 504.46306

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CN2CCCN(CC2)C(=O)C3=C(C(=NN3CC)C)Br

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CN2CCCN(CC2)C(=O)C3=C(C(=NN3CC)C)Br

InChI

InChI=1S/C24H34BrN5O2/c1-5-18-10-8-11-19(6-2)22(18)26-20(31)16-28-12-9-13-29(15-14-28)24(32)23-21(25)17(4)27-30(23)7-3/h8,10-11H,5-7,9,12-16H2,1-4H3,(H,26,31)