N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)-4-(trifluoromethyl)benzamide

Systemtic Name: N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)-4-(trifluoromethyl)benzamide Openeye Name: N-(5-allylsulfanyl-1,3,4-thiadiazol-2-yl)-4-(trifluoromethyl)benzamide CAS Name: N-[5-(prop-2-enylthio)-1,3,4-thiadiazol-2-yl]-4-(trifluoromethyl)benzamide IUPAC Name: N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)-4-(trifluoromethyl)benzamide Traditional Name: N-[5-(allylthio)-1,3,4-thiadiazol-2-yl]-4-(trifluoromethyl)benzamide Formula: C13H10F3N3OS2 MolecularWeight: 345.36321

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

C=CCSC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C13H10F3N3OS2/c1-2-7-21-12-19-18-11(22-12)17-10(20)8-3-5-9(6-4-8)13(14,15)16/h2-6H,1,7H2,(H,17,18,20)