N-ethyl-2-[[2-(2-phenoxyethoxy)phenyl]carbonylcarbamothioylamino]-N-phenyl-benzamide

Systemtic Name: N-ethyl-2-[[2-(2-phenoxyethoxy)phenyl]carbonylcarbamothioylamino]-N-phenyl-benzamide Openeye Name: N-ethyl-2-[[2-(2-phenoxyethoxy)benzoyl]carbamothioylamino]-N-phenyl-benzamide CAS Name: N-ethyl-2-[[[[oxo-[2-(2-phenoxyethoxy)phenyl]methyl]amino]-sulfanylidenemethyl]amino]-N-phenylbenzamide IUPAC Name: N-ethyl-2-[[2-(2-phenoxyethoxy)benzoyl]carbamothioylamino]-N-phenylbenzamide Traditional Name: N-ethyl-2-[[2-(2-phenoxyethoxy)benzoyl]thiocarbamoylamino]-N-phenyl-benzamide Formula: C31H29N3O4S MolecularWeight: 539.64466

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC=CC=C3OCCOC4=CC=CC=C4

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC=CC=C3OCCOC4=CC=CC=C4

InChI

InChI=1S/C31H29N3O4S/c1-2-34(23-13-5-3-6-14-23)30(36)25-17-9-11-19-27(25)32-31(39)33-29(35)26-18-10-12-20-28(26)38-22-21-37-24-15-7-4-8-16-24/h3-20H,2,21-22H2,1H3,(H2,32,33,35,39)