5-[(5-bromanyl-2-oxidanyl-phenyl)methylamino]-1H-pyrazole-4-carbonitrile

Systemtic Name: 5-[(5-bromanyl-2-oxidanyl-phenyl)methylamino]-1H-pyrazole-4-carbonitrile Openeye Name: 5-[(5-bromo-2-hydroxy-phenyl)methylamino]-1H-pyrazole-4-carbonitrile CAS Name: 5-[(5-bromo-2-hydroxyphenyl)methylamino]-1H-pyrazole-4-carbonitrile IUPAC Name: 5-[(5-bromo-2-hydroxyphenyl)methylamino]-1H-pyrazole-4-carbonitrile Traditional Name: 5-[(5-bromo-2-hydroxy-benzyl)amino]-1H-pyrazole-4-carbonitrile Formula: C11H9BrN4O MolecularWeight: 293.11936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)CNC2=C(C=NN2)C#N)O

Isomeric SMILES

C1=CC(=C(C=C1Br)CNC2=C(C=NN2)C#N)O

InChI

InChI=1S/C11H9BrN4O/c12-9-1-2-10(17)7(3-9)5-14-11-8(4-13)6-15-16-11/h1-3,6,17H,5H2,(H2,14,15,16)