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

Systemtic Name: 3,5-bis(chloranyl)-N-[[3-(cyclohexylcarbamoyl)phenyl]carbamothioyl]benzamide Openeye Name: 3,5-dichloro-N-[[3-(cyclohexylcarbamoyl)phenyl]carbamothioyl]benzamide CAS Name: 3,5-dichloro-N-[[3-[(cyclohexylamino)-oxomethyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,5-dichloro-N-[[3-(cyclohexylcarbamoyl)phenyl]carbamothioyl]benzamide Traditional Name: 3,5-dichloro-N-[[3-(cyclohexylcarbamoyl)phenyl]thiocarbamoyl]benzamide Formula: C21H21Cl2N3O2S MolecularWeight: 450.38134

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=CC(=CC=C2)NC(=S)NC(=O)C3=CC(=CC(=C3)Cl)Cl

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=CC(=CC=C2)NC(=S)NC(=O)C3=CC(=CC(=C3)Cl)Cl

InChI

InChI=1S/C21H21Cl2N3O2S/c22-15-9-14(10-16(23)12-15)20(28)26-21(29)25-18-8-4-5-13(11-18)19(27)24-17-6-2-1-3-7-17/h4-5,8-12,17H,1-3,6-7H2,(H,24,27)(H2,25,26,28,29)