4-[bis(fluoranyl)methylsulfonyl]-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 4-[bis(fluoranyl)methylsulfonyl]-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 4-(difluoromethylsulfonyl)-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 4-(difluoromethylsulfonyl)-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-(difluoromethylsulfonyl)-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 4-(difluoromethylsulfonyl)-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]benzamide Formula: C12H11F2N3O3S3 MolecularWeight: 379.425846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11F2N3O3S3/c1-2-21-12-17-16-11(22-12)15-9(18)7-3-5-8(6-4-7)23(19,20)10(13)14/h3-6,10H,2H2,1H3,(H,15,16,18)