2-chloranyl-N-cyclohexyl-5-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]benzamide

Systemtic Name: 2-chloranyl-N-cyclohexyl-5-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]benzamide Openeye Name: 2-chloro-N-cyclohexyl-5-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]benzamide CAS Name: 2-chloro-N-cyclohexyl-5-[[[[(E)-1-oxo-3-phenylprop-2-enyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: 2-chloro-N-cyclohexyl-5-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]benzamide Traditional Name: 2-chloro-N-cyclohexyl-5-[[(E)-3-phenylacryloyl]thiocarbamoylamino]benzamide Formula: C23H24ClN3O2S MolecularWeight: 441.97356

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=C(C=CC(=C2)NC(=S)NC(=O)C=CC3=CC=CC=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C23H24ClN3O2S/c24-20-13-12-18(15-19(20)22(29)25-17-9-5-2-6-10-17)26-23(30)27-21(28)14-11-16-7-3-1-4-8-16/h1,3-4,7-8,11-15,17H,2,5-6,9-10H2,(H,25,29)(H2,26,27,28,30)/b14-11+