3-chloranyl-N-[[2-chloranyl-5-(propanoylamino)phenyl]carbamothioyl]-4-methyl-benzamide

Systemtic Name: 3-chloranyl-N-[[2-chloranyl-5-(propanoylamino)phenyl]carbamothioyl]-4-methyl-benzamide Openeye Name: 3-chloro-N-[[2-chloro-5-(propanoylamino)phenyl]carbamothioyl]-4-methyl-benzamide CAS Name: 3-chloro-N-[[2-chloro-5-(1-oxopropylamino)anilino]-sulfanylidenemethyl]-4-methylbenzamide IUPAC Name: 3-chloro-N-[[2-chloro-5-(propanoylamino)phenyl]carbamothioyl]-4-methylbenzamide Traditional Name: 3-chloro-N-[(2-chloro-5-propionamido-phenyl)thiocarbamoyl]-4-methyl-benzamide Formula: C18H17Cl2N3O2S MolecularWeight: 410.31748

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(C=C1)Cl)NC(=S)NC(=O)C2=CC(=C(C=C2)C)Cl

Isomeric SMILES

CCC(=O)NC1=CC(=C(C=C1)Cl)NC(=S)NC(=O)C2=CC(=C(C=C2)C)Cl

InChI

InChI=1S/C18H17Cl2N3O2S/c1-3-16(24)21-12-6-7-13(19)15(9-12)22-18(26)23-17(25)11-5-4-10(2)14(20)8-11/h4-9H,3H2,1-2H3,(H,21,24)(H2,22,23,25,26)