2-[2-(4-chlorophenyl)ethanoylcarbamothioyl-methyl-amino]-N-cyclohexyl-benzamide

Systemtic Name: 2-[2-(4-chlorophenyl)ethanoylcarbamothioyl-methyl-amino]-N-cyclohexyl-benzamide Openeye Name: 2-[[2-(4-chlorophenyl)acetyl]carbamothioyl-methyl-amino]-N-cyclohexyl-benzamide CAS Name: 2-[[[[2-(4-chlorophenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]-methylamino]-N-cyclohexylbenzamide IUPAC Name: 2-[[2-(4-chlorophenyl)acetyl]carbamothioyl-methylamino]-N-cyclohexylbenzamide Traditional Name: 2-[[2-(4-chlorophenyl)acetyl]thiocarbamoyl-methyl-amino]-N-cyclohexyl-benzamide Formula: C23H26ClN3O2S MolecularWeight: 443.98944

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)NC2CCCCC2)C(=S)NC(=O)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)NC2CCCCC2)C(=S)NC(=O)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H26ClN3O2S/c1-27(23(30)26-21(28)15-16-11-13-17(24)14-12-16)20-10-6-5-9-19(20)22(29)25-18-7-3-2-4-8-18/h5-6,9-14,18H,2-4,7-8,15H2,1H3,(H,25,29)(H,26,28,30)