5-azanyl-3-butyl-1-phenyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-3-butyl-1-phenyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-butyl-1-phenyl-pyrazole-4-carbonitrile CAS Name: 5-amino-3-butyl-1-phenyl-4-pyrazolecarbonitrile IUPAC Name: 5-amino-3-butyl-1-phenylpyrazole-4-carbonitrile Traditional Name: 5-amino-3-butyl-1-phenyl-pyrazole-4-carbonitrile Formula: C14H16N4 MolecularWeight: 240.30364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN(C(=C1C#N)N)C2=CC=CC=C2

Isomeric SMILES

CCCCC1=NN(C(=C1C#N)N)C2=CC=CC=C2

InChI

InChI=1S/C14H16N4/c1-2-3-9-13-12(10-15)14(16)18(17-13)11-7-5-4-6-8-11/h4-8H,2-3,9,16H2,1H3