4-butoxy-N-[(3-chloranyl-2-methyl-phenyl)carbamothioyl]benzamide

Systemtic Name: 4-butoxy-N-[(3-chloranyl-2-methyl-phenyl)carbamothioyl]benzamide Openeye Name: 4-butoxy-N-[(3-chloro-2-methyl-phenyl)carbamothioyl]benzamide CAS Name: 4-butoxy-N-[(3-chloro-2-methylanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-butoxy-N-[(3-chloro-2-methylphenyl)carbamothioyl]benzamide Traditional Name: 4-butoxy-N-[(3-chloro-2-methyl-phenyl)thiocarbamoyl]benzamide Formula: C19H21ClN2O2S MolecularWeight: 376.90024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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