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

Systemtic Name: N-ethyl-2-[[3-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]benzamide Openeye Name: N-ethyl-2-[(3-isopentyloxybenzoyl)carbamothioylamino]benzamide CAS Name: N-ethyl-2-[[[[[3-(3-methylbutoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-ethyl-2-[[3-(3-methylbutoxy)benzoyl]carbamothioylamino]benzamide Traditional Name: N-ethyl-2-[(3-isoamoxybenzoyl)thiocarbamoylamino]benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC=CC=C1NC(=S)NC(=O)C2=CC(=CC=C2)OCCC(C)C

Isomeric SMILES

CCNC(=O)C1=CC=CC=C1NC(=S)NC(=O)C2=CC(=CC=C2)OCCC(C)C

InChI

InChI=1S/C22H27N3O3S/c1-4-23-21(27)18-10-5-6-11-19(18)24-22(29)25-20(26)16-8-7-9-17(14-16)28-13-12-15(2)3/h5-11,14-15H,4,12-13H2,1-3H3,(H,23,27)(H2,24,25,26,29)