3-fluoranyl-4-methoxy-N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzenesulfonamide

Systemtic Name: 3-fluoranyl-4-methoxy-N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzenesulfonamide Openeye Name: 3-fluoro-4-methoxy-N-[5-(p-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzenesulfonamide CAS Name: 3-fluoro-4-methoxy-N-[5-[(4-methylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]benzenesulfonamide IUPAC Name: 3-fluoro-4-methoxy-N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzenesulfonamide Traditional Name: 3-fluoro-4-methoxy-N-[5-[(4-methylbenzyl)thio]-1,3,4-thiadiazol-2-yl]benzenesulfonamide Formula: C17H16FN3O3S3 MolecularWeight: 425.520643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(S2)NS(=O)(=O)C3=CC(=C(C=C3)OC)F

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(S2)NS(=O)(=O)C3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C17H16FN3O3S3/c1-11-3-5-12(6-4-11)10-25-17-20-19-16(26-17)21-27(22,23)13-7-8-15(24-2)14(18)9-13/h3-9H,10H2,1-2H3,(H,19,21)