4-[[4-(2-phenoxyethoxy)phenyl]carbonylcarbamothioylamino]-N-(1-phenylethyl)benzamide

Systemtic Name: 4-[[4-(2-phenoxyethoxy)phenyl]carbonylcarbamothioylamino]-N-(1-phenylethyl)benzamide Openeye Name: 4-[[4-(2-phenoxyethoxy)benzoyl]carbamothioylamino]-N-(1-phenylethyl)benzamide CAS Name: 4-[[[[oxo-[4-(2-phenoxyethoxy)phenyl]methyl]amino]-sulfanylidenemethyl]amino]-N-(1-phenylethyl)benzamide IUPAC Name: 4-[[4-(2-phenoxyethoxy)benzoyl]carbamothioylamino]-N-(1-phenylethyl)benzamide Traditional Name: 4-[[4-(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=C(C=C2)NC(=S)NC(=O)C3=CC=C(C=C3)OCCOC4=CC=CC=C4

Isomeric SMILES

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

InChI

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