5-[(4-acetamidophenyl)sulfanylmethyl]-N-[(4-fluorophenyl)methyl]-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: 5-[(4-acetamidophenyl)sulfanylmethyl]-N-[(4-fluorophenyl)methyl]-1,3,4-thiadiazole-2-carboxamide Openeye Name: 5-[(4-acetamidophenyl)sulfanylmethyl]-N-[(4-fluorophenyl)methyl]-1,3,4-thiadiazole-2-carboxamide CAS Name: 5-[[(4-acetamidophenyl)thio]methyl]-N-[(4-fluorophenyl)methyl]-1,3,4-thiadiazole-2-carboxamide IUPAC Name: 5-[(4-acetamidophenyl)sulfanylmethyl]-N-[(4-fluorophenyl)methyl]-1,3,4-thiadiazole-2-carboxamide Traditional Name: 5-[[(4-acetamidophenyl)thio]methyl]-N-(4-fluorobenzyl)-1,3,4-thiadiazole-2-carboxamide Formula: C19H17FN4O2S2 MolecularWeight: 416.492283

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SCC2=NN=C(S2)C(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SCC2=NN=C(S2)C(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C19H17FN4O2S2/c1-12(25)22-15-6-8-16(9-7-15)27-11-17-23-24-19(28-17)18(26)21-10-13-2-4-14(20)5-3-13/h2-9H,10-11H2,1H3,(H,21,26)(H,22,25)