2-[(3-phenethyloxyphenyl)carbonylcarbamothioylamino]-N-propyl-benzamide

Systemtic Name: 2-[(3-phenethyloxyphenyl)carbonylcarbamothioylamino]-N-propyl-benzamide Openeye Name: 2-[(3-phenethyloxybenzoyl)carbamothioylamino]-N-propyl-benzamide CAS Name: 2-[[[[oxo-(3-phenethyloxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]-N-propylbenzamide IUPAC Name: 2-[(3-phenethyloxybenzoyl)carbamothioylamino]-N-propylbenzamide Traditional Name: 2-[(3-phenethyloxybenzoyl)thiocarbamoylamino]-N-propyl-benzamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=CC=C1NC(=S)NC(=O)C2=CC(=CC=C2)OCCC3=CC=CC=C3

Isomeric SMILES

CCCNC(=O)C1=CC=CC=C1NC(=S)NC(=O)C2=CC(=CC=C2)OCCC3=CC=CC=C3

InChI

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