3-[4-(4-fluorophenyl)sulfanylphenyl]pyrazole-1-carboxamide

Systemtic Name: 3-[4-(4-fluorophenyl)sulfanylphenyl]pyrazole-1-carboxamide Openeye Name: 3-[4-(4-fluorophenyl)sulfanylphenyl]pyrazole-1-carboxamide CAS Name: 3-[4-[(4-fluorophenyl)thio]phenyl]-1-pyrazolecarboxamide IUPAC Name: 3-[4-(4-fluorophenyl)sulfanylphenyl]pyrazole-1-carboxamide Traditional Name: 3-[4-[(4-fluorophenyl)thio]phenyl]pyrazole-1-carboxamide Formula: C16H12FN3OS MolecularWeight: 313.349383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN(C=C2)C(=O)N)SC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC(=CC=C1C2=NN(C=C2)C(=O)N)SC3=CC=C(C=C3)F

InChI

InChI=1S/C16H12FN3OS/c17-12-3-7-14(8-4-12)22-13-5-1-11(2-6-13)15-9-10-20(19-15)16(18)21/h1-10H,(H2,18,21)