N-(5-octyl-1,3,4-thiadiazol-2-yl)-3-(phenylsulfonylmethyl)furan-2-carboxamide

Systemtic Name: N-(5-octyl-1,3,4-thiadiazol-2-yl)-3-(phenylsulfonylmethyl)furan-2-carboxamide Openeye Name: 3-(benzenesulfonylmethyl)-N-(5-octyl-1,3,4-thiadiazol-2-yl)furan-2-carboxamide CAS Name: 3-(benzenesulfonylmethyl)-N-(5-octyl-1,3,4-thiadiazol-2-yl)-2-furancarboxamide IUPAC Name: 3-(benzenesulfonylmethyl)-N-(5-octyl-1,3,4-thiadiazol-2-yl)furan-2-carboxamide Traditional Name: 3-(besylmethyl)-N-(5-octyl-1,3,4-thiadiazol-2-yl)-2-furamide Formula: C22H27N3O4S2 MolecularWeight: 461.59748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=NN=C(S1)NC(=O)C2=C(C=CO2)CS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCC1=NN=C(S1)NC(=O)C2=C(C=CO2)CS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H27N3O4S2/c1-2-3-4-5-6-10-13-19-24-25-22(30-19)23-21(26)20-17(14-15-29-20)16-31(27,28)18-11-8-7-9-12-18/h7-9,11-12,14-15H,2-6,10,13,16H2,1H3,(H,23,25,26)