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

Systemtic Name: N-[[2,5-bis(chloranyl)phenyl]carbamothioyl]-3-butoxy-benzamide Openeye Name: 3-butoxy-N-[(2,5-dichlorophenyl)carbamothioyl]benzamide CAS Name: 3-butoxy-N-[(2,5-dichloroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[(2,5-dichlorophenyl)carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[(2,5-dichlorophenyl)thiocarbamoyl]benzamide Formula: C18H18Cl2N2O2S MolecularWeight: 397.31872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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