N-[(hexanoylamino)carbamothioyl]-2-hexoxy-benzamide

Systemtic Name: N-[(hexanoylamino)carbamothioyl]-2-hexoxy-benzamide Openeye Name: N-[(hexanoylamino)carbamothioyl]-2-hexoxy-benzamide CAS Name: 2-hexoxy-N-[(1-oxohexylhydrazo)-sulfanylidenemethyl]benzamide IUPAC Name: N-[(hexanoylamino)carbamothioyl]-2-hexoxybenzamide Traditional Name: N-[(caproylamino)thiocarbamoyl]-2-hexoxy-benzamide Formula: C20H31N3O3S MolecularWeight: 393.54344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)CCCCC

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)CCCCC

InChI

InChI=1S/C20H31N3O3S/c1-3-5-7-11-15-26-17-13-10-9-12-16(17)19(25)21-20(27)23-22-18(24)14-8-6-4-2/h9-10,12-13H,3-8,11,14-15H2,1-2H3,(H,22,24)(H2,21,23,25,27)