5-[(4-tert-butylphenyl)methylsulfanyl]-3-(4-fluorophenyl)-1,3,4-thiadiazole-2-thione

Systemtic Name: 5-[(4-tert-butylphenyl)methylsulfanyl]-3-(4-fluorophenyl)-1,3,4-thiadiazole-2-thione Openeye Name: 5-[(4-tert-butylphenyl)methylsulfanyl]-3-(4-fluorophenyl)-1,3,4-thiadiazole-2-thione CAS Name: 5-[(4-tert-butylphenyl)methylthio]-3-(4-fluorophenyl)-1,3,4-thiadiazole-2-thione IUPAC Name: 5-[(4-tert-butylphenyl)methylsulfanyl]-3-(4-fluorophenyl)-1,3,4-thiadiazole-2-thione Traditional Name: 5-[(4-tert-butylbenzyl)thio]-3-(4-fluorophenyl)-1,3,4-thiadiazole-2-thione Formula: C19H19FN2S3 MolecularWeight: 390.560963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NN(C(=S)S2)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NN(C(=S)S2)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H19FN2S3/c1-19(2,3)14-6-4-13(5-7-14)12-24-17-21-22(18(23)25-17)16-10-8-15(20)9-11-16/h4-11H,12H2,1-3H3