N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-5-(phenylsulfonylmethyl)furan-2-carboxamide

Systemtic Name: N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-5-(phenylsulfonylmethyl)furan-2-carboxamide Openeye Name: 5-(benzenesulfonylmethyl)-N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]furan-2-carboxamide CAS Name: 5-(benzenesulfonylmethyl)-N-[5-[(4-cyanophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-2-furancarboxamide IUPAC Name: 5-(benzenesulfonylmethyl)-N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]furan-2-carboxamide Traditional Name: 5-(besylmethyl)-N-[5-[(4-cyanobenzyl)thio]-1,3,4-thiadiazol-2-yl]-2-furamide Formula: C22H16N4O4S3 MolecularWeight: 496.58184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CC2=CC=C(O2)C(=O)NC3=NN=C(S3)SCC4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CC2=CC=C(O2)C(=O)NC3=NN=C(S3)SCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H16N4O4S3/c23-12-15-6-8-16(9-7-15)13-31-22-26-25-21(32-22)24-20(27)19-11-10-17(30-19)14-33(28,29)18-4-2-1-3-5-18/h1-11H,13-14H2,(H,24,25,27)