2-chloranyl-N-cyclohexyl-5-[(2-hexoxyphenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: 2-chloranyl-N-cyclohexyl-5-[(2-hexoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: 2-chloro-N-cyclohexyl-5-[(2-hexoxybenzoyl)carbamothioylamino]benzamide CAS Name: 2-chloro-N-cyclohexyl-5-[[[[(2-hexoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: 2-chloro-N-cyclohexyl-5-[(2-hexoxybenzoyl)carbamothioylamino]benzamide Traditional Name: 2-chloro-N-cyclohexyl-5-[(2-hexoxybenzoyl)thiocarbamoylamino]benzamide Formula: C27H34ClN3O3S MolecularWeight: 516.09516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC(=C(C=C2)Cl)C(=O)NC3CCCCC3

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC(=C(C=C2)Cl)C(=O)NC3CCCCC3

InChI

InChI=1S/C27H34ClN3O3S/c1-2-3-4-10-17-34-24-14-9-8-13-21(24)25(32)31-27(35)30-20-15-16-23(28)22(18-20)26(33)29-19-11-6-5-7-12-19/h8-9,13-16,18-19H,2-7,10-12,17H2,1H3,(H,29,33)(H2,30,31,32,35)