N-(2-hydroxyethyl)-2-[[4-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]benzamide

Systemtic Name: N-(2-hydroxyethyl)-2-[[4-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]benzamide Openeye Name: N-(2-hydroxyethyl)-2-[(4-isopentyloxybenzoyl)carbamothioylamino]benzamide CAS Name: N-(2-hydroxyethyl)-2-[[[[[4-(3-methylbutoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(2-hydroxyethyl)-2-[[4-(3-methylbutoxy)benzoyl]carbamothioylamino]benzamide Traditional Name: N-(2-hydroxyethyl)-2-[(4-isoamoxybenzoyl)thiocarbamoylamino]benzamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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