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

Systemtic Name: N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]pentanamide Openeye Name: N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]pentanamide CAS Name: N-[[[2-(3,4-dimethylphenoxy)-1-oxopropyl]hydrazo]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]pentanamide Traditional Name: N-[[2-(3,4-dimethylphenoxy)propanoylamino]thiocarbamoyl]valeramide Formula: C17H25N3O3S MolecularWeight: 351.4637

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25N3O3S/c1-5-6-7-15(21)18-17(24)20-19-16(22)13(4)23-14-9-8-11(2)12(3)10-14/h8-10,13H,5-7H2,1-4H3,(H,19,22)(H2,18,20,21,24)