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

Systemtic Name: 3-[[3-(2-ethoxyethoxy)phenyl]carbonylcarbamothioylamino]-N-propyl-benzamide Openeye Name: 3-[[3-(2-ethoxyethoxy)benzoyl]carbamothioylamino]-N-propyl-benzamide CAS Name: 3-[[[[[3-(2-ethoxyethoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-propylbenzamide IUPAC Name: 3-[[3-(2-ethoxyethoxy)benzoyl]carbamothioylamino]-N-propylbenzamide Traditional Name: 3-[[3-(2-ethoxyethoxy)benzoyl]thiocarbamoylamino]-N-propyl-benzamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O4S/c1-3-11-23-20(26)16-7-5-9-18(14-16)24-22(30)25-21(27)17-8-6-10-19(15-17)29-13-12-28-4-2/h5-10,14-15H,3-4,11-13H2,1-2H3,(H,23,26)(H2,24,25,27,30)