N-cyclohexyl-3-[[4-(2-phenoxyethoxy)phenyl]carbonylcarbamothioylamino]benzamide

Systemtic Name: N-cyclohexyl-3-[[4-(2-phenoxyethoxy)phenyl]carbonylcarbamothioylamino]benzamide Openeye Name: N-cyclohexyl-3-[[4-(2-phenoxyethoxy)benzoyl]carbamothioylamino]benzamide CAS Name: N-cyclohexyl-3-[[[[oxo-[4-(2-phenoxyethoxy)phenyl]methyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-cyclohexyl-3-[[4-(2-phenoxyethoxy)benzoyl]carbamothioylamino]benzamide Traditional Name: N-cyclohexyl-3-[[4-(2-phenoxyethoxy)benzoyl]thiocarbamoylamino]benzamide Formula: C29H31N3O4S MolecularWeight: 517.63914

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=CC(=CC=C2)NC(=S)NC(=O)C3=CC=C(C=C3)OCCOC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=CC(=CC=C2)NC(=S)NC(=O)C3=CC=C(C=C3)OCCOC4=CC=CC=C4

InChI

InChI=1S/C29H31N3O4S/c33-27(21-14-16-26(17-15-21)36-19-18-35-25-12-5-2-6-13-25)32-29(37)31-24-11-7-8-22(20-24)28(34)30-23-9-3-1-4-10-23/h2,5-8,11-17,20,23H,1,3-4,9-10,18-19H2,(H,30,34)(H2,31,32,33,37)