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

Systemtic Name: 2-hexoxy-N-[[(4-hexoxyphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 2-hexoxy-N-[[(4-hexoxybenzoyl)amino]carbamothioyl]benzamide CAS Name: 2-hexoxy-N-[[[(4-hexoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 2-hexoxy-N-[[(4-hexoxybenzoyl)amino]carbamothioyl]benzamide Traditional Name: 2-hexoxy-N-[[(4-hexoxybenzoyl)amino]thiocarbamoyl]benzamide Formula: C27H37N3O4S MolecularWeight: 499.66538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=CC=C2OCCCCCC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=CC=C2OCCCCCC

InChI

InChI=1S/C27H37N3O4S/c1-3-5-7-11-19-33-22-17-15-21(16-18-22)25(31)29-30-27(35)28-26(32)23-13-9-10-14-24(23)34-20-12-8-6-4-2/h9-10,13-18H,3-8,11-12,19-20H2,1-2H3,(H,29,31)(H2,28,30,32,35)