N-[[3-(1-phenylethylcarbamoyl)phenyl]carbamothioyl]-2-propoxy-benzamide

Systemtic Name: N-[[3-(1-phenylethylcarbamoyl)phenyl]carbamothioyl]-2-propoxy-benzamide Openeye Name: N-[[3-(1-phenylethylcarbamoyl)phenyl]carbamothioyl]-2-propoxy-benzamide CAS Name: N-[[3-[oxo-(1-phenylethylamino)methyl]anilino]-sulfanylidenemethyl]-2-propoxybenzamide IUPAC Name: N-[[3-(1-phenylethylcarbamoyl)phenyl]carbamothioyl]-2-propoxybenzamide Traditional Name: N-[[3-(1-phenylethylcarbamoyl)phenyl]thiocarbamoyl]-2-propoxy-benzamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC(C)C3=CC=CC=C3

Isomeric SMILES

CCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC(C)C3=CC=CC=C3

InChI

InChI=1S/C26H27N3O3S/c1-3-16-32-23-15-8-7-14-22(23)25(31)29-26(33)28-21-13-9-12-20(17-21)24(30)27-18(2)19-10-5-4-6-11-19/h4-15,17-18H,3,16H2,1-2H3,(H,27,30)(H2,28,29,31,33)