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

Systemtic Name: N-[5-[(2-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-5-(phenylsulfonyl)furan-2-carboxamide Openeye Name: 5-(benzenesulfonyl)-N-[5-(o-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]furan-2-carboxamide CAS Name: 5-(benzenesulfonyl)-N-[5-[(2-methylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]-2-furancarboxamide IUPAC Name: 5-(benzenesulfonyl)-N-[5-[(2-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]furan-2-carboxamide Traditional Name: 5-besyl-N-[5-[(2-methylbenzyl)thio]-1,3,4-thiadiazol-2-yl]-2-furamide Formula: C21H17N3O4S3 MolecularWeight: 471.57238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NN=C(S2)NC(=O)C3=CC=C(O3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1CSC2=NN=C(S2)NC(=O)C3=CC=C(O3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H17N3O4S3/c1-14-7-5-6-8-15(14)13-29-21-24-23-20(30-21)22-19(25)17-11-12-18(28-17)31(26,27)16-9-3-2-4-10-16/h2-12H,13H2,1H3,(H,22,23,25)