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

Systemtic Name: 2,3-bis(chloranyl)-N-[4-(propanoylcarbamothioylamino)phenyl]benzamide Openeye Name: 2,3-dichloro-N-[4-(propanoylcarbamothioylamino)phenyl]benzamide CAS Name: 2,3-dichloro-N-[4-[[(1-oxopropylamino)-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 2,3-dichloro-N-[4-(propanoylcarbamothioylamino)phenyl]benzamide Traditional Name: 2,3-dichloro-N-[4-(propionylthiocarbamoylamino)phenyl]benzamide Formula: C17H15Cl2N3O2S MolecularWeight: 396.2909

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15Cl2N3O2S/c1-2-14(23)22-17(25)21-11-8-6-10(7-9-11)20-16(24)12-4-3-5-13(18)15(12)19/h3-9H,2H2,1H3,(H,20,24)(H2,21,22,23,25)