S-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl] 4-fluoranylbenzenecarbothioate

Systemtic Name: S-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl] 4-fluoranylbenzenecarbothioate Openeye Name: S-[5-(1-naphthylmethylsulfanyl)-1,3,4-thiadiazol-2-yl] 4-fluorobenzenecarbothioate CAS Name: 4-fluorobenzenecarbothioic acid S-[5-(1-naphthalenylmethylthio)-1,3,4-thiadiazol-2-yl] ester IUPAC Name: S-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl] 4-fluorobenzenecarbothioate Traditional Name: 4-fluorothiobenzoic acid S-[5-(1-naphthylmethylthio)-1,3,4-thiadiazol-2-yl] ester Formula: C20H13FN2OS3 MolecularWeight: 412.523423

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CSC3=NN=C(S3)SC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CSC3=NN=C(S3)SC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H13FN2OS3/c21-16-10-8-14(9-11-16)18(24)26-20-23-22-19(27-20)25-12-15-6-3-5-13-4-1-2-7-17(13)15/h1-11H,12H2