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

Systemtic Name: N-[[3-(butanoylamino)phenyl]carbamothioyl]-3,5-bis(chloranyl)benzamide Openeye Name: N-[[3-(butanoylamino)phenyl]carbamothioyl]-3,5-dichloro-benzamide CAS Name: 3,5-dichloro-N-[[3-(1-oxobutylamino)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[3-(butanoylamino)phenyl]carbamothioyl]-3,5-dichlorobenzamide Traditional Name: N-[(3-butyramidophenyl)thiocarbamoyl]-3,5-dichloro-benzamide Formula: C18H17Cl2N3O2S MolecularWeight: 410.31748

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC(=CC(=C2)Cl)Cl

Isomeric SMILES

CCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC(=CC(=C2)Cl)Cl

InChI

InChI=1S/C18H17Cl2N3O2S/c1-2-4-16(24)21-14-5-3-6-15(10-14)22-18(26)23-17(25)11-7-12(19)9-13(20)8-11/h3,5-10H,2,4H2,1H3,(H,21,24)(H2,22,23,25,26)