N-[[(4-tert-butylphenyl)carbonylamino]carbamothioyl]-2-hexoxy-benzamide

Systemtic Name: N-[[(4-tert-butylphenyl)carbonylamino]carbamothioyl]-2-hexoxy-benzamide Openeye Name: N-[[(4-tert-butylbenzoyl)amino]carbamothioyl]-2-hexoxy-benzamide CAS Name: N-[[[(4-tert-butylphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-hexoxybenzamide IUPAC Name: N-[[(4-tert-butylbenzoyl)amino]carbamothioyl]-2-hexoxybenzamide Traditional Name: N-[[(4-tert-butylbenzoyl)amino]thiocarbamoyl]-2-hexoxy-benzamide Formula: C25H33N3O3S MolecularWeight: 455.61282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C25H33N3O3S/c1-5-6-7-10-17-31-21-12-9-8-11-20(21)23(30)26-24(32)28-27-22(29)18-13-15-19(16-14-18)25(2,3)4/h8-9,11-16H,5-7,10,17H2,1-4H3,(H,27,29)(H2,26,28,30,32)