3,5-bis(chloranyl)-N-[[4-(2-diethylaminoethylcarbamoyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3,5-bis(chloranyl)-N-[[4-(2-diethylaminoethylcarbamoyl)phenyl]carbamothioyl]benzamide Openeye Name: 3,5-dichloro-N-[[4-(2-diethylaminoethylcarbamoyl)phenyl]carbamothioyl]benzamide CAS Name: 3,5-dichloro-N-[[4-[(2-diethylaminoethylamino)-oxomethyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,5-dichloro-N-[[4-(2-diethylaminoethylcarbamoyl)phenyl]carbamothioyl]benzamide Traditional Name: 3,5-dichloro-N-[[4-(2-diethylaminoethylcarbamoyl)phenyl]thiocarbamoyl]benzamide Formula: C21H24Cl2N4O2S MolecularWeight: 467.41186

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC(=C2)Cl)Cl

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC(=C2)Cl)Cl

InChI

InChI=1S/C21H24Cl2N4O2S/c1-3-27(4-2)10-9-24-19(28)14-5-7-18(8-6-14)25-21(30)26-20(29)15-11-16(22)13-17(23)12-15/h5-8,11-13H,3-4,9-10H2,1-2H3,(H,24,28)(H2,25,26,29,30)