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

Systemtic Name: 2-butoxy-N-[(hexanoylamino)carbamothioyl]benzamide Openeye Name: 2-butoxy-N-[(hexanoylamino)carbamothioyl]benzamide CAS Name: 2-butoxy-N-[(1-oxohexylhydrazo)-sulfanylidenemethyl]benzamide IUPAC Name: 2-butoxy-N-[(hexanoylamino)carbamothioyl]benzamide Traditional Name: 2-butoxy-N-[(caproylamino)thiocarbamoyl]benzamide Formula: C18H27N3O3S MolecularWeight: 365.49028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NNC(=S)NC(=O)C1=CC=CC=C1OCCCC

Isomeric SMILES

CCCCCC(=O)NNC(=S)NC(=O)C1=CC=CC=C1OCCCC

InChI

InChI=1S/C18H27N3O3S/c1-3-5-7-12-16(22)20-21-18(25)19-17(23)14-10-8-9-11-15(14)24-13-6-4-2/h8-11H,3-7,12-13H2,1-2H3,(H,20,22)(H2,19,21,23,25)