4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]benzamide

Systemtic Name: 4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]benzamide Openeye Name: 4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-[4-(isopropylcarbamoylamino)phenyl]benzamide CAS Name: 4-(4-bromo-3,5-dimethyl-1-pyrazolyl)-N-[4-[[oxo-(propan-2-ylamino)methyl]amino]phenyl]benzamide IUPAC Name: 4-(4-bromo-3,5-dimethylpyrazol-1-yl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]benzamide Traditional Name: 4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-[4-(isopropylcarbamoylamino)phenyl]benzamide Formula: C22H24BrN5O2 MolecularWeight: 470.36226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)NC(=O)NC(C)C)C)Br

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)NC(=O)NC(C)C)C)Br

InChI

InChI=1S/C22H24BrN5O2/c1-13(2)24-22(30)26-18-9-7-17(8-10-18)25-21(29)16-5-11-19(12-6-16)28-15(4)20(23)14(3)27-28/h5-13H,1-4H3,(H,25,29)(H2,24,26,30)