S-phthalazin-1-yl 4-fluoranylbenzenecarbothioate

Systemtic Name: S-phthalazin-1-yl 4-fluoranylbenzenecarbothioate Openeye Name: S-phthalazin-1-yl 4-fluorobenzenecarbothioate CAS Name: 4-fluorobenzenecarbothioic acid S-(1-phthalazinyl) ester IUPAC Name: S-phthalazin-1-yl 4-fluorobenzenecarbothioate Traditional Name: 4-fluorothiobenzoic acid S-phthalazin-1-yl ester Formula: C15H9FN2OS MolecularWeight: 284.308163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NN=C2SC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C2C(=C1)C=NN=C2SC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C15H9FN2OS/c16-12-7-5-10(6-8-12)15(19)20-14-13-4-2-1-3-11(13)9-17-18-14/h1-9H