2-[[4-(2-methylpropoxy)phenyl]carbonylcarbamothioylamino]-N-(3-oxidanylpropyl)benzamide

Systemtic Name: 2-[[4-(2-methylpropoxy)phenyl]carbonylcarbamothioylamino]-N-(3-oxidanylpropyl)benzamide Openeye Name: N-(3-hydroxypropyl)-2-[(4-isobutoxybenzoyl)carbamothioylamino]benzamide CAS Name: N-(3-hydroxypropyl)-2-[[[[[4-(2-methylpropoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(3-hydroxypropyl)-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]benzamide Traditional Name: N-(3-hydroxypropyl)-2-[(4-isobutoxybenzoyl)thiocarbamoylamino]benzamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCCCO

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCCCO

InChI

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