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

Systemtic Name: N-cyclohexyl-3-[[3-(2-phenoxyethoxy)phenyl]carbonylcarbamothioylamino]benzamide Openeye Name: N-cyclohexyl-3-[[3-(2-phenoxyethoxy)benzoyl]carbamothioylamino]benzamide CAS Name: N-cyclohexyl-3-[[[[oxo-[3-(2-phenoxyethoxy)phenyl]methyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-cyclohexyl-3-[[3-(2-phenoxyethoxy)benzoyl]carbamothioylamino]benzamide Traditional Name: N-cyclohexyl-3-[[3-(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(=CC=C3)OCCOC4=CC=CC=C4

Isomeric SMILES

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

InChI

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