4-heptoxy-N-[[(4-hexoxyphenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 4-heptoxy-N-[[(4-hexoxyphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 4-heptoxy-N-[[(4-hexoxybenzoyl)amino]carbamothioyl]benzamide CAS Name: 4-heptoxy-N-[[[(4-hexoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-heptoxy-N-[[(4-hexoxybenzoyl)amino]carbamothioyl]benzamide Traditional Name: 4-heptoxy-N-[[(4-hexoxybenzoyl)amino]thiocarbamoyl]benzamide Formula: C28H39N3O4S MolecularWeight: 513.69196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)OCCCCCC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)OCCCCCC

InChI

InChI=1S/C28H39N3O4S/c1-3-5-7-9-11-21-35-24-16-12-22(13-17-24)26(32)29-28(36)31-30-27(33)23-14-18-25(19-15-23)34-20-10-8-6-4-2/h12-19H,3-11,20-21H2,1-2H3,(H,30,33)(H2,29,31,32,36)