4-ethyl-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide

Systemtic Name: 4-ethyl-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide Openeye Name: 4-ethyl-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide CAS Name: 4-ethyl-N-[[3-(1-oxopropylamino)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-ethyl-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide Traditional Name: 4-ethyl-N-[(3-propionamidophenyl)thiocarbamoyl]benzamide Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)CC

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)CC

InChI

InChI=1S/C19H21N3O2S/c1-3-13-8-10-14(11-9-13)18(24)22-19(25)21-16-7-5-6-15(12-16)20-17(23)4-2/h5-12H,3-4H2,1-2H3,(H,20,23)(H2,21,22,24,25)