3-butoxy-N-[(4-chloranyl-2,5-dimethoxy-phenyl)carbamothioyl]benzamide

Systemtic Name: 3-butoxy-N-[(4-chloranyl-2,5-dimethoxy-phenyl)carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[(4-chloro-2,5-dimethoxy-phenyl)carbamothioyl]benzamide CAS Name: 3-butoxy-N-[(4-chloro-2,5-dimethoxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[(4-chloro-2,5-dimethoxy-phenyl)thiocarbamoyl]benzamide Formula: C20H23ClN2O4S MolecularWeight: 422.92562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC(=C(C=C2OC)Cl)OC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC(=C(C=C2OC)Cl)OC

InChI

InChI=1S/C20H23ClN2O4S/c1-4-5-9-27-14-8-6-7-13(10-14)19(24)23-20(28)22-16-12-17(25-2)15(21)11-18(16)26-3/h6-8,10-12H,4-5,9H2,1-3H3,(H2,22,23,24,28)