4-bromanyl-N-[(E)-1-[3-(2-ethylbutanoylamino)phenyl]ethylideneamino]-2-methyl-pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-N-[(E)-1-[3-(2-ethylbutanoylamino)phenyl]ethylideneamino]-2-methyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-N-[(E)-1-[3-(2-ethylbutanoylamino)phenyl]ethylideneamino]-2-methyl-pyrazole-3-carboxamide CAS Name: 4-bromo-N-[(E)-1-[3-[(2-ethyl-1-oxobutyl)amino]phenyl]ethylideneamino]-2-methyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-[(E)-1-[3-(2-ethylbutanoylamino)phenyl]ethylideneamino]-2-methylpyrazole-3-carboxamide Traditional Name: 4-bromo-N-[(E)-1-[3-(2-ethylbutanoylamino)phenyl]ethylideneamino]-2-methyl-pyrazole-3-carboxamide Formula: C19H24BrN5O2 MolecularWeight: 434.33016

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NC1=CC=CC(=C1)C(=NNC(=O)C2=C(C=NN2C)Br)C

Isomeric SMILES

CCC(CC)C(=O)NC1=CC=CC(=C1)/C(=N/NC(=O)C2=C(C=NN2C)Br)/C

InChI

InChI=1S/C19H24BrN5O2/c1-5-13(6-2)18(26)22-15-9-7-8-14(10-15)12(3)23-24-19(27)17-16(20)11-21-25(17)4/h7-11,13H,5-6H2,1-4H3,(H,22,26)(H,24,27)/b23-12+