4-fluoranyl-3-(pyrazol-1-ylmethyl)benzenecarbothioamide

Systemtic Name: 4-fluoranyl-3-(pyrazol-1-ylmethyl)benzenecarbothioamide Openeye Name: 4-fluoro-3-(pyrazol-1-ylmethyl)benzenecarbothioamide CAS Name: 4-fluoro-3-(1-pyrazolylmethyl)benzenecarbothioamide IUPAC Name: 4-fluoro-3-(pyrazol-1-ylmethyl)benzenecarbothioamide Traditional Name: 4-fluoro-3-(pyrazol-1-ylmethyl)thiobenzamide Formula: C11H10FN3S MolecularWeight: 235.280603

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)CC2=C(C=CC(=C2)C(=S)N)F

Isomeric SMILES

C1=CN(N=C1)CC2=C(C=CC(=C2)C(=S)N)F

InChI

InChI=1S/C11H10FN3S/c12-10-3-2-8(11(13)16)6-9(10)7-15-5-1-4-14-15/h1-6H,7H2,(H2,13,16)