2-hexoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide

Systemtic Name: 2-hexoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide Openeye Name: 2-hexoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide CAS Name: 2-hexoxy-N-[[3-(1-oxopropylamino)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-hexoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide Traditional Name: 2-hexoxy-N-[(3-propionamidophenyl)thiocarbamoyl]benzamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)CC

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)CC

InChI

InChI=1S/C23H29N3O3S/c1-3-5-6-9-15-29-20-14-8-7-13-19(20)22(28)26-23(30)25-18-12-10-11-17(16-18)24-21(27)4-2/h7-8,10-14,16H,3-6,9,15H2,1-2H3,(H,24,27)(H2,25,26,28,30)