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

Systemtic Name: 3-chloranyl-4-methoxy-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide Openeye Name: 3-chloro-4-methoxy-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide CAS Name: 3-chloro-4-methoxy-N-[[4-(1-oxopropylamino)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-chloro-4-methoxy-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide Traditional Name: 3-chloro-4-methoxy-N-[(4-propionamidophenyl)thiocarbamoyl]benzamide Formula: C18H18ClN3O3S MolecularWeight: 391.87182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18ClN3O3S/c1-3-16(23)20-12-5-7-13(8-6-12)21-18(26)22-17(24)11-4-9-15(25-2)14(19)10-11/h4-10H,3H2,1-2H3,(H,20,23)(H2,21,22,24,26)