N-[[3-(2-phenylethanoylamino)phenyl]carbamothioyl]hexanamide

Systemtic Name: N-[[3-(2-phenylethanoylamino)phenyl]carbamothioyl]hexanamide Openeye Name: N-[[3-[(2-phenylacetyl)amino]phenyl]carbamothioyl]hexanamide CAS Name: N-[[3-[(1-oxo-2-phenylethyl)amino]anilino]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[[3-[(2-phenylacetyl)amino]phenyl]carbamothioyl]hexanamide Traditional Name: N-[[3-[(2-phenylacetyl)amino]phenyl]thiocarbamoyl]hexanamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=CC=CC(=C1)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=CC=CC(=C1)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C21H25N3O2S/c1-2-3-5-13-19(25)24-21(27)23-18-12-8-11-17(15-18)22-20(26)14-16-9-6-4-7-10-16/h4,6-12,15H,2-3,5,13-14H2,1H3,(H,22,26)(H2,23,24,25,27)