(E)-3-[(5-phenyl-1H-pyrazol-3-yl)amino]but-2-enenitrile

Systemtic Name: (E)-3-[(5-phenyl-1H-pyrazol-3-yl)amino]but-2-enenitrile Openeye Name: (E)-3-[(5-phenyl-1H-pyrazol-3-yl)amino]but-2-enenitrile CAS Name: (E)-3-[(5-phenyl-1H-pyrazol-3-yl)amino]-2-butenenitrile IUPAC Name: (E)-3-[(5-phenyl-1H-pyrazol-3-yl)amino]but-2-enenitrile Traditional Name: (E)-3-[(5-phenyl-1H-pyrazol-3-yl)amino]but-2-enenitrile Formula: C13H12N4 MolecularWeight: 224.26118

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC#N)NC1=NNC(=C1)C2=CC=CC=C2

Isomeric SMILES

C/C(=C\C#N)/NC1=NNC(=C1)C2=CC=CC=C2

InChI

InChI=1S/C13H12N4/c1-10(7-8-14)15-13-9-12(16-17-13)11-5-3-2-4-6-11/h2-7,9H,1H3,(H2,15,16,17)/b10-7+