2-[4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-ethoxy-6-iodanyl-phenoxy]-N-phenethyl-ethanamide

Systemtic Name: 2-[4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-ethoxy-6-iodanyl-phenoxy]-N-phenethyl-ethanamide Openeye Name: 2-[4-[(E)-(carbamothioylhydrazono)methyl]-2-ethoxy-6-iodo-phenoxy]-N-phenethyl-acetamide CAS Name: 2-[4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-ethoxy-6-iodophenoxy]-N-phenethylacetamide IUPAC Name: 2-[4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-ethoxy-6-iodophenoxy]-N-phenethylacetamide Traditional Name: 2-[2-ethoxy-6-iodo-4-[(E)-(thiocarbamoylhydrazono)methyl]phenoxy]-N-phenethyl-acetamide Formula: C20H23IN4O3S MolecularWeight: 526.39109

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=NNC(=S)N)I)OCC(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=N/NC(=S)N)I)OCC(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C20H23IN4O3S/c1-2-27-17-11-15(12-24-25-20(22)29)10-16(21)19(17)28-13-18(26)23-9-8-14-6-4-3-5-7-14/h3-7,10-12H,2,8-9,13H2,1H3,(H,23,26)(H3,22,25,29)/b24-12+