3-[[3-(2-ethoxyethoxy)phenyl]carbonylcarbamothioylamino]-N-ethyl-benzamide

Systemtic Name: 3-[[3-(2-ethoxyethoxy)phenyl]carbonylcarbamothioylamino]-N-ethyl-benzamide Openeye Name: 3-[[3-(2-ethoxyethoxy)benzoyl]carbamothioylamino]-N-ethyl-benzamide CAS Name: 3-[[[[[3-(2-ethoxyethoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-ethylbenzamide IUPAC Name: 3-[[3-(2-ethoxyethoxy)benzoyl]carbamothioylamino]-N-ethylbenzamide Traditional Name: 3-[[3-(2-ethoxyethoxy)benzoyl]thiocarbamoylamino]-N-ethyl-benzamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCOCC

Isomeric SMILES

CCNC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCOCC

InChI

InChI=1S/C21H25N3O4S/c1-3-22-19(25)15-7-5-9-17(13-15)23-21(29)24-20(26)16-8-6-10-18(14-16)28-12-11-27-4-2/h5-10,13-14H,3-4,11-12H2,1-2H3,(H,22,25)(H2,23,24,26,29)