3-(phenylmethyl)sulfonyl-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]propanamide

Systemtic Name: 3-(phenylmethyl)sulfonyl-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: 3-benzylsulfonyl-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]propanamide CAS Name: 3-(phenylmethyl)sulfonyl-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: 3-benzylsulfonyl-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: 3-benzylsulfonyl-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]propionamide Formula: C13H12F3N3O3S2 MolecularWeight: 379.37789

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)CCC(=O)NC2=NN=C(S2)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)CCC(=O)NC2=NN=C(S2)C(F)(F)F

InChI

InChI=1S/C13H12F3N3O3S2/c14-13(15,16)11-18-19-12(23-11)17-10(20)6-7-24(21,22)8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,17,19,20)