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

Systemtic Name: 2-ethoxy-N-[[(4-hexoxyphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 2-ethoxy-N-[[(4-hexoxybenzoyl)amino]carbamothioyl]benzamide CAS Name: 2-ethoxy-N-[[[(4-hexoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 2-ethoxy-N-[[(4-hexoxybenzoyl)amino]carbamothioyl]benzamide Traditional Name: 2-ethoxy-N-[[(4-hexoxybenzoyl)amino]thiocarbamoyl]benzamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=CC=C2OCC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=CC=C2OCC

InChI

InChI=1S/C23H29N3O4S/c1-3-5-6-9-16-30-18-14-12-17(13-15-18)21(27)25-26-23(31)24-22(28)19-10-7-8-11-20(19)29-4-2/h7-8,10-15H,3-6,9,16H2,1-2H3,(H,25,27)(H2,24,26,28,31)