2-bromanyl-N-[3-methyl-1-oxidanylidene-1-(3-pyrazol-1-ylpropylamino)butan-2-yl]benzamide

Systemtic Name: 2-bromanyl-N-[3-methyl-1-oxidanylidene-1-(3-pyrazol-1-ylpropylamino)butan-2-yl]benzamide Openeye Name: 2-bromo-N-[2-methyl-1-(3-pyrazol-1-ylpropylcarbamoyl)propyl]benzamide CAS Name: 2-bromo-N-[3-methyl-1-oxo-1-[3-(1-pyrazolyl)propylamino]butan-2-yl]benzamide IUPAC Name: 2-bromo-N-[3-methyl-1-oxo-1-(3-pyrazol-1-ylpropylamino)butan-2-yl]benzamide Traditional Name: 2-bromo-N-[2-methyl-1-(3-pyrazol-1-ylpropylcarbamoyl)propyl]benzamide Formula: C18H23BrN4O2 MolecularWeight: 407.30482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCCN1C=CC=N1)NC(=O)C2=CC=CC=C2Br

Isomeric SMILES

CC(C)C(C(=O)NCCCN1C=CC=N1)NC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C18H23BrN4O2/c1-13(2)16(22-17(24)14-7-3-4-8-15(14)19)18(25)20-9-5-11-23-12-6-10-21-23/h3-4,6-8,10,12-13,16H,5,9,11H2,1-2H3,(H,20,25)(H,22,24)