2-[[3-(2-phenoxyethoxy)phenyl]carbonylcarbamothioylamino]-N-(1-phenylethyl)benzamide

Systemtic Name: 2-[[3-(2-phenoxyethoxy)phenyl]carbonylcarbamothioylamino]-N-(1-phenylethyl)benzamide Openeye Name: 2-[[3-(2-phenoxyethoxy)benzoyl]carbamothioylamino]-N-(1-phenylethyl)benzamide CAS Name: 2-[[[[oxo-[3-(2-phenoxyethoxy)phenyl]methyl]amino]-sulfanylidenemethyl]amino]-N-(1-phenylethyl)benzamide IUPAC Name: 2-[[3-(2-phenoxyethoxy)benzoyl]carbamothioylamino]-N-(1-phenylethyl)benzamide Traditional Name: 2-[[3-(2-phenoxyethoxy)benzoyl]thiocarbamoylamino]-N-(1-phenylethyl)benzamide Formula: C31H29N3O4S MolecularWeight: 539.64466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC(=CC=C3)OCCOC4=CC=CC=C4

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC(=CC=C3)OCCOC4=CC=CC=C4

InChI

InChI=1S/C31H29N3O4S/c1-22(23-11-4-2-5-12-23)32-30(36)27-17-8-9-18-28(27)33-31(39)34-29(35)24-13-10-16-26(21-24)38-20-19-37-25-14-6-3-7-15-25/h2-18,21-22H,19-20H2,1H3,(H,32,36)(H2,33,34,35,39)