N-[[(2-methoxyphenyl)carbonylamino]carbamothioyl]octanamide

Systemtic Name: N-[[(2-methoxyphenyl)carbonylamino]carbamothioyl]octanamide Openeye Name: N-[[(2-methoxybenzoyl)amino]carbamothioyl]octanamide CAS Name: N-[[[(2-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]octanamide IUPAC Name: N-[[(2-methoxybenzoyl)amino]carbamothioyl]octanamide Traditional Name: N-[(o-anisoylamino)thiocarbamoyl]caprylamide Formula: C17H25N3O3S MolecularWeight: 351.4637

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NNC(=O)C1=CC=CC=C1OC

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NNC(=O)C1=CC=CC=C1OC

InChI

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