N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]hexanamide

Systemtic Name: N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]hexanamide Openeye Name: N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]hexanamide CAS Name: N-[[[2-(3,4-dimethylphenoxy)-1-oxopropyl]hydrazo]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]hexanamide Traditional Name: N-[[2-(3,4-dimethylphenoxy)propanoylamino]thiocarbamoyl]hexanamide Formula: C18H27N3O3S MolecularWeight: 365.49028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NNC(=O)C(C)OC1=CC(=C(C=C1)C)C

Isomeric SMILES

CCCCCC(=O)NC(=S)NNC(=O)C(C)OC1=CC(=C(C=C1)C)C

InChI

InChI=1S/C18H27N3O3S/c1-5-6-7-8-16(22)19-18(25)21-20-17(23)14(4)24-15-10-9-12(2)13(3)11-15/h9-11,14H,5-8H2,1-4H3,(H,20,23)(H2,19,21,22,25)