3-butyl-N-[(5-chloranyl-2-oxidanyl-phenyl)carbamothioyl]benzamide

Systemtic Name: 3-butyl-N-[(5-chloranyl-2-oxidanyl-phenyl)carbamothioyl]benzamide Openeye Name: 3-butyl-N-[(5-chloro-2-hydroxy-phenyl)carbamothioyl]benzamide CAS Name: 3-butyl-N-[(5-chloro-2-hydroxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-butyl-N-[(5-chloro-2-hydroxyphenyl)carbamothioyl]benzamide Traditional Name: 3-butyl-N-[(5-chloro-2-hydroxy-phenyl)thiocarbamoyl]benzamide Formula: C18H19ClN2O2S MolecularWeight: 362.87366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)Cl)O

Isomeric SMILES

CCCCC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)Cl)O

InChI

InChI=1S/C18H19ClN2O2S/c1-2-3-5-12-6-4-7-13(10-12)17(23)21-18(24)20-15-11-14(19)8-9-16(15)22/h4,6-11,22H,2-3,5H2,1H3,(H2,20,21,23,24)