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

Systemtic Name: N-[[2,3-bis(chloranyl)phenyl]carbamothioyl]-4-butoxy-benzamide Openeye Name: 4-butoxy-N-[(2,3-dichlorophenyl)carbamothioyl]benzamide CAS Name: 4-butoxy-N-[(2,3-dichloroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-butoxy-N-[(2,3-dichlorophenyl)carbamothioyl]benzamide Traditional Name: 4-butoxy-N-[(2,3-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=C(C(=CC=C2)Cl)Cl

Isomeric SMILES

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

InChI

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