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

Systemtic Name: N-[[3,5-bis(chloranyl)phenyl]carbamothioyl]-4-butoxy-benzamide Openeye Name: 4-butoxy-N-[(3,5-dichlorophenyl)carbamothioyl]benzamide CAS Name: 4-butoxy-N-[(3,5-dichloroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-butoxy-N-[(3,5-dichlorophenyl)carbamothioyl]benzamide Traditional Name: 4-butoxy-N-[(3,5-dichlorophenyl)thiocarbamoyl]benzamide Formula: C18H18Cl2N2O2S MolecularWeight: 397.31872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18Cl2N2O2S/c1-2-3-8-24-16-6-4-12(5-7-16)17(23)22-18(25)21-15-10-13(19)9-14(20)11-15/h4-7,9-11H,2-3,8H2,1H3,(H2,21,22,23,25)