N-[[3-(butanoylamino)phenyl]carbamothioyl]hexanamide

Systemtic Name: N-[[3-(butanoylamino)phenyl]carbamothioyl]hexanamide Openeye Name: N-[[3-(butanoylamino)phenyl]carbamothioyl]hexanamide CAS Name: N-[[3-(1-oxobutylamino)anilino]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[[3-(butanoylamino)phenyl]carbamothioyl]hexanamide Traditional Name: N-[(3-butyramidophenyl)thiocarbamoyl]hexanamide Formula: C17H25N3O2S MolecularWeight: 335.4643

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=CC=CC(=C1)NC(=O)CCC

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=CC=CC(=C1)NC(=O)CCC

InChI

InChI=1S/C17H25N3O2S/c1-3-5-6-11-16(22)20-17(23)19-14-10-7-9-13(12-14)18-15(21)8-4-2/h7,9-10,12H,3-6,8,11H2,1-2H3,(H,18,21)(H2,19,20,22,23)