N-[[(4-tert-butylphenyl)carbonylamino]carbamothioyl]octanamide

Systemtic Name: N-[[(4-tert-butylphenyl)carbonylamino]carbamothioyl]octanamide Openeye Name: N-[[(4-tert-butylbenzoyl)amino]carbamothioyl]octanamide CAS Name: N-[[[(4-tert-butylphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]octanamide IUPAC Name: N-[[(4-tert-butylbenzoyl)amino]carbamothioyl]octanamide Traditional Name: N-[[(4-tert-butylbenzoyl)amino]thiocarbamoyl]caprylamide Formula: C20H31N3O2S MolecularWeight: 377.54404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H31N3O2S/c1-5-6-7-8-9-10-17(24)21-19(26)23-22-18(25)15-11-13-16(14-12-15)20(2,3)4/h11-14H,5-10H2,1-4H3,(H,22,25)(H2,21,23,24,26)