N-[[4-(phenethylsulfamoyl)phenyl]carbamothioyl]pentanamide

Systemtic Name: N-[[4-(phenethylsulfamoyl)phenyl]carbamothioyl]pentanamide Openeye Name: N-[[4-(phenethylsulfamoyl)phenyl]carbamothioyl]pentanamide CAS Name: N-[[4-(phenethylsulfamoyl)anilino]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[[4-(phenethylsulfamoyl)phenyl]carbamothioyl]pentanamide Traditional Name: N-[[4-(phenethylsulfamoyl)phenyl]thiocarbamoyl]valeramide Formula: C20H25N3O3S2 MolecularWeight: 419.5608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CCCCC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C20H25N3O3S2/c1-2-3-9-19(24)23-20(27)22-17-10-12-18(13-11-17)28(25,26)21-15-14-16-7-5-4-6-8-16/h4-8,10-13,21H,2-3,9,14-15H2,1H3,(H2,22,23,24,27)