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

Systemtic Name: 4-chloranyl-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide Openeye Name: 4-chloro-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide CAS Name: 4-chloro-N-[[3-(1-oxopropylamino)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-chloro-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide Traditional Name: 4-chloro-N-[(3-propionamidophenyl)thiocarbamoyl]benzamide Formula: C17H16ClN3O2S MolecularWeight: 361.84584

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H16ClN3O2S/c1-2-15(22)19-13-4-3-5-14(10-13)20-17(24)21-16(23)11-6-8-12(18)9-7-11/h3-10H,2H2,1H3,(H,19,22)(H2,20,21,23,24)