S-[1-(phenylmethyl)imidazol-2-yl] 4-fluoranylbenzenecarbothioate

Systemtic Name: S-[1-(phenylmethyl)imidazol-2-yl] 4-fluoranylbenzenecarbothioate Openeye Name: S-(1-benzylimidazol-2-yl) 4-fluorobenzenecarbothioate CAS Name: 4-fluorobenzenecarbothioic acid S-[1-(phenylmethyl)-2-imidazolyl] ester IUPAC Name: S-(1-benzylimidazol-2-yl) 4-fluorobenzenecarbothioate Traditional Name: 4-fluorothiobenzoic acid S-(1-benzylimidazol-2-yl) ester Formula: C17H13FN2OS MolecularWeight: 312.361323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=CN=C2SC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C(C=C1)CN2C=CN=C2SC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H13FN2OS/c18-15-8-6-14(7-9-15)16(21)22-17-19-10-11-20(17)12-13-4-2-1-3-5-13/h1-11H,12H2