4-[5-azanyl-1-(4-fluorophenyl)pyrazol-4-yl]carbonylbenzenecarbonitrile

Systemtic Name: 4-[5-azanyl-1-(4-fluorophenyl)pyrazol-4-yl]carbonylbenzenecarbonitrile Openeye Name: 4-[5-amino-1-(4-fluorophenyl)pyrazole-4-carbonyl]benzonitrile CAS Name: 4-[[5-amino-1-(4-fluorophenyl)-4-pyrazolyl]-oxomethyl]benzonitrile IUPAC Name: 4-[5-amino-1-(4-fluorophenyl)pyrazole-4-carbonyl]benzonitrile Traditional Name: 4-[5-amino-1-(4-fluorophenyl)pyrazole-4-carbonyl]benzonitrile Formula: C17H11FN4O MolecularWeight: 306.293843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(=O)C2=C(N(N=C2)C3=CC=C(C=C3)F)N

Isomeric SMILES

C1=CC(=CC=C1C#N)C(=O)C2=C(N(N=C2)C3=CC=C(C=C3)F)N

InChI

InChI=1S/C17H11FN4O/c18-13-5-7-14(8-6-13)22-17(20)15(10-21-22)16(23)12-3-1-11(9-19)2-4-12/h1-8,10H,20H2