3-[(4-phenethyloxyphenyl)carbonylcarbamothioylamino]-N-propyl-benzamide

Systemtic Name: 3-[(4-phenethyloxyphenyl)carbonylcarbamothioylamino]-N-propyl-benzamide Openeye Name: 3-[(4-phenethyloxybenzoyl)carbamothioylamino]-N-propyl-benzamide CAS Name: 3-[[[[oxo-(4-phenethyloxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]-N-propylbenzamide IUPAC Name: 3-[(4-phenethyloxybenzoyl)carbamothioylamino]-N-propylbenzamide Traditional Name: 3-[(4-phenethyloxybenzoyl)thiocarbamoylamino]-N-propyl-benzamide Formula: C26H27N3O3S MolecularWeight: 461.57588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCCC3=CC=CC=C3

Isomeric SMILES

CCCNC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCCC3=CC=CC=C3

InChI

InChI=1S/C26H27N3O3S/c1-2-16-27-24(30)21-9-6-10-22(18-21)28-26(33)29-25(31)20-11-13-23(14-12-20)32-17-15-19-7-4-3-5-8-19/h3-14,18H,2,15-17H2,1H3,(H,27,30)(H2,28,29,31,33)