S-[[3-cyano-4-(4-fluorophenyl)-6-phenyl-pyridin-2-yl]methyl] thiophene-2-carbothioate

Systemtic Name: S-[[3-cyano-4-(4-fluorophenyl)-6-phenyl-pyridin-2-yl]methyl] thiophene-2-carbothioate Openeye Name: S-[[3-cyano-4-(4-fluorophenyl)-6-phenyl-2-pyridyl]methyl] thiophene-2-carbothioate CAS Name: 2-thiophenecarbothioic acid S-[[3-cyano-4-(4-fluorophenyl)-6-phenyl-2-pyridinyl]methyl] ester IUPAC Name: S-[[3-cyano-4-(4-fluorophenyl)-6-phenylpyridin-2-yl]methyl] thiophene-2-carbothioate Traditional Name: thiophene-2-carbothioic acid S-[[3-cyano-4-(4-fluorophenyl)-6-phenyl-2-pyridyl]methyl] ester Formula: C24H15FN2OS2 MolecularWeight: 430.517103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=C(C=C3)F)C#N)CSC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=C(C=C3)F)C#N)CSC(=O)C4=CC=CS4

InChI

InChI=1S/C24H15FN2OS2/c25-18-10-8-16(9-11-18)19-13-21(17-5-2-1-3-6-17)27-22(20(19)14-26)15-30-24(28)23-7-4-12-29-23/h1-13H,15H2