N-[[4-chloranyl-2-(phenylcarbonyl)phenyl]carbamothioyl]-3,5-dimethyl-benzamide

Systemtic Name: N-[[4-chloranyl-2-(phenylcarbonyl)phenyl]carbamothioyl]-3,5-dimethyl-benzamide Openeye Name: N-[(2-benzoyl-4-chloro-phenyl)carbamothioyl]-3,5-dimethyl-benzamide CAS Name: N-[(2-benzoyl-4-chloroanilino)-sulfanylidenemethyl]-3,5-dimethylbenzamide IUPAC Name: N-[(2-benzoyl-4-chlorophenyl)carbamothioyl]-3,5-dimethylbenzamide Traditional Name: N-[(2-benzoyl-4-chloro-phenyl)thiocarbamoyl]-3,5-dimethyl-benzamide Formula: C23H19ClN2O2S MolecularWeight: 422.92716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C23H19ClN2O2S/c1-14-10-15(2)12-17(11-14)22(28)26-23(29)25-20-9-8-18(24)13-19(20)21(27)16-6-4-3-5-7-16/h3-13H,1-2H3,(H2,25,26,28,29)