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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCCO

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCCO

InChI

InChI=1S/C22H27N3O4S/c1-15(2)10-13-29-17-7-5-6-16(14-17)20(27)25-22(30)24-19-9-4-3-8-18(19)21(28)23-11-12-26/h3-9,14-15,26H,10-13H2,1-2H3,(H,23,28)(H2,24,25,27,30)