N-[[2-(4-chlorophenyl)ethanoylamino]carbamothioyl]cyclohexanecarboxamide

Systemtic Name: N-[[2-(4-chlorophenyl)ethanoylamino]carbamothioyl]cyclohexanecarboxamide Openeye Name: N-[[[2-(4-chlorophenyl)acetyl]amino]carbamothioyl]cyclohexanecarboxamide CAS Name: N-[[[2-(4-chlorophenyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]cyclohexanecarboxamide IUPAC Name: N-[[[2-(4-chlorophenyl)acetyl]amino]carbamothioyl]cyclohexanecarboxamide Traditional Name: N-[[[2-(4-chlorophenyl)acetyl]amino]thiocarbamoyl]cyclohexanecarboxamide Formula: C16H20ClN3O2S MolecularWeight: 353.8669

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC(=S)NNC(=O)CC2=CC=C(C=C2)Cl

Isomeric SMILES

C1CCC(CC1)C(=O)NC(=S)NNC(=O)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H20ClN3O2S/c17-13-8-6-11(7-9-13)10-14(21)19-20-16(23)18-15(22)12-4-2-1-3-5-12/h6-9,12H,1-5,10H2,(H,19,21)(H2,18,20,22,23)