2-chloranyl-N-cyclohexyl-5-[2-(4-methoxyphenyl)ethanoylcarbamothioylamino]benzamide

Systemtic Name: 2-chloranyl-N-cyclohexyl-5-[2-(4-methoxyphenyl)ethanoylcarbamothioylamino]benzamide Openeye Name: 2-chloro-N-cyclohexyl-5-[[2-(4-methoxyphenyl)acetyl]carbamothioylamino]benzamide CAS Name: 2-chloro-N-cyclohexyl-5-[[[[2-(4-methoxyphenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: 2-chloro-N-cyclohexyl-5-[[2-(4-methoxyphenyl)acetyl]carbamothioylamino]benzamide Traditional Name: 2-chloro-N-cyclohexyl-5-[[2-(4-methoxyphenyl)acetyl]thiocarbamoylamino]benzamide Formula: C23H26ClN3O3S MolecularWeight: 459.98884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)NC(=S)NC2=CC(=C(C=C2)Cl)C(=O)NC3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)NC(=S)NC2=CC(=C(C=C2)Cl)C(=O)NC3CCCCC3

InChI

InChI=1S/C23H26ClN3O3S/c1-30-18-10-7-15(8-11-18)13-21(28)27-23(31)26-17-9-12-20(24)19(14-17)22(29)25-16-5-3-2-4-6-16/h7-12,14,16H,2-6,13H2,1H3,(H,25,29)(H2,26,27,28,31)