N-[[4-(prop-2-enylsulfamoyl)phenyl]carbamothioyl]octanamide

Systemtic Name: N-[[4-(prop-2-enylsulfamoyl)phenyl]carbamothioyl]octanamide Openeye Name: N-[[4-(allylsulfamoyl)phenyl]carbamothioyl]octanamide CAS Name: N-[[4-(prop-2-enylsulfamoyl)anilino]-sulfanylidenemethyl]octanamide IUPAC Name: N-[[4-(prop-2-enylsulfamoyl)phenyl]carbamothioyl]octanamide Traditional Name: N-[[4-(allylsulfamoyl)phenyl]thiocarbamoyl]caprylamide Formula: C18H27N3O3S2 MolecularWeight: 397.55528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O3S2/c1-3-5-6-7-8-9-17(22)21-18(25)20-15-10-12-16(13-11-15)26(23,24)19-14-4-2/h4,10-13,19H,2-3,5-9,14H2,1H3,(H2,20,21,22,25)