3-[[4-(2-phenoxyethoxy)phenyl]carbonylcarbamothioylamino]-N-propyl-benzamide

Systemtic Name: 3-[[4-(2-phenoxyethoxy)phenyl]carbonylcarbamothioylamino]-N-propyl-benzamide Openeye Name: 3-[[4-(2-phenoxyethoxy)benzoyl]carbamothioylamino]-N-propyl-benzamide CAS Name: 3-[[[[oxo-[4-(2-phenoxyethoxy)phenyl]methyl]amino]-sulfanylidenemethyl]amino]-N-propylbenzamide IUPAC Name: 3-[[4-(2-phenoxyethoxy)benzoyl]carbamothioylamino]-N-propylbenzamide Traditional Name: 3-[[4-(2-phenoxyethoxy)benzoyl]thiocarbamoylamino]-N-propyl-benzamide Formula: C26H27N3O4S MolecularWeight: 477.57528

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCCOC3=CC=CC=C3

Isomeric SMILES

CCCNC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCCOC3=CC=CC=C3

InChI

InChI=1S/C26H27N3O4S/c1-2-15-27-24(30)20-7-6-8-21(18-20)28-26(34)29-25(31)19-11-13-23(14-12-19)33-17-16-32-22-9-4-3-5-10-22/h3-14,18H,2,15-17H2,1H3,(H,27,30)(H2,28,29,31,34)