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

Systemtic Name: 3-butoxy-N-[(3-chloranyl-4-methyl-phenyl)carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[(3-chloro-4-methyl-phenyl)carbamothioyl]benzamide CAS Name: 3-butoxy-N-[(3-chloro-4-methylanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[(3-chloro-4-methylphenyl)carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[(3-chloro-4-methyl-phenyl)thiocarbamoyl]benzamide Formula: C19H21ClN2O2S MolecularWeight: 376.90024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)C)Cl

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)C)Cl

InChI

InChI=1S/C19H21ClN2O2S/c1-3-4-10-24-16-7-5-6-14(11-16)18(23)22-19(25)21-15-9-8-13(2)17(20)12-15/h5-9,11-12H,3-4,10H2,1-2H3,(H2,21,22,23,25)