N-[[2-(4-octoxyphenoxy)ethanoylamino]carbamothioyl]furan-2-carboxamide

Systemtic Name: N-[[2-(4-octoxyphenoxy)ethanoylamino]carbamothioyl]furan-2-carboxamide Openeye Name: N-[[[2-(4-octoxyphenoxy)acetyl]amino]carbamothioyl]furan-2-carboxamide CAS Name: N-[[[2-(4-octoxyphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: N-[[[2-(4-octoxyphenoxy)acetyl]amino]carbamothioyl]furan-2-carboxamide Traditional Name: N-[[[2-(4-octoxyphenoxy)acetyl]amino]thiocarbamoyl]-2-furamide Formula: C22H29N3O5S MolecularWeight: 447.54776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2=CC=CO2

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2=CC=CO2

InChI

InChI=1S/C22H29N3O5S/c1-2-3-4-5-6-7-14-28-17-10-12-18(13-11-17)30-16-20(26)24-25-22(31)23-21(27)19-9-8-15-29-19/h8-13,15H,2-7,14,16H2,1H3,(H,24,26)(H2,23,25,27,31)