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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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