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

Systemtic Name: 2-[[3-(2-phenoxyethoxy)phenyl]carbonylcarbamothioylamino]-N-(4-phenylazanylphenyl)benzamide Openeye Name: N-(4-anilinophenyl)-2-[[3-(2-phenoxyethoxy)benzoyl]carbamothioylamino]benzamide CAS Name: N-(4-anilinophenyl)-2-[[[[oxo-[3-(2-phenoxyethoxy)phenyl]methyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(4-anilinophenyl)-2-[[3-(2-phenoxyethoxy)benzoyl]carbamothioylamino]benzamide Traditional Name: N-(4-anilinophenyl)-2-[[3-(2-phenoxyethoxy)benzoyl]thiocarbamoylamino]benzamide Formula: C35H30N4O4S MolecularWeight: 602.7021

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3NC(=S)NC(=O)C4=CC(=CC=C4)OCCOC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3NC(=S)NC(=O)C4=CC(=CC=C4)OCCOC5=CC=CC=C5

InChI

InChI=1S/C35H30N4O4S/c40-33(25-10-9-15-30(24-25)43-23-22-42-29-13-5-2-6-14-29)39-35(44)38-32-17-8-7-16-31(32)34(41)37-28-20-18-27(19-21-28)36-26-11-3-1-4-12-26/h1-21,24,36H,22-23H2,(H,37,41)(H2,38,39,40,44)