N-[[4-(oxolan-2-ylmethylsulfamoyl)phenyl]carbamothioyl]octanamide

Systemtic Name: N-[[4-(oxolan-2-ylmethylsulfamoyl)phenyl]carbamothioyl]octanamide Openeye Name: N-[[4-(tetrahydrofuran-2-ylmethylsulfamoyl)phenyl]carbamothioyl]octanamide CAS Name: N-[[4-(2-oxolanylmethylsulfamoyl)anilino]-sulfanylidenemethyl]octanamide IUPAC Name: N-[[4-(oxolan-2-ylmethylsulfamoyl)phenyl]carbamothioyl]octanamide Traditional Name: N-[[4-(tetrahydrofurfurylsulfamoyl)phenyl]thiocarbamoyl]caprylamide Formula: C20H31N3O4S2 MolecularWeight: 441.60784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)NCC2CCCO2

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)NCC2CCCO2

InChI

InChI=1S/C20H31N3O4S2/c1-2-3-4-5-6-9-19(24)23-20(28)22-16-10-12-18(13-11-16)29(25,26)21-15-17-8-7-14-27-17/h10-13,17,21H,2-9,14-15H2,1H3,(H2,22,23,24,28)