N-[3-(4-ethoxyphenoxy)-5-nitro-phenyl]-2-(thiophen-2-ylmethylsulfanyl)ethanamide

Systemtic Name: N-[3-(4-ethoxyphenoxy)-5-nitro-phenyl]-2-(thiophen-2-ylmethylsulfanyl)ethanamide Openeye Name: N-[3-(4-ethoxyphenoxy)-5-nitro-phenyl]-2-(2-thienylmethylsulfanyl)acetamide CAS Name: N-[3-(4-ethoxyphenoxy)-5-nitrophenyl]-2-(thiophen-2-ylmethylthio)acetamide IUPAC Name: N-[3-(4-ethoxyphenoxy)-5-nitrophenyl]-2-(thiophen-2-ylmethylsulfanyl)acetamide Traditional Name: N-[3-(4-ethoxyphenoxy)-5-nitro-phenyl]-2-(2-thenylthio)acetamide Formula: C21H20N2O5S2 MolecularWeight: 444.5239

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CSCC3=CC=CS3

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CSCC3=CC=CS3

InChI

InChI=1S/C21H20N2O5S2/c1-2-27-17-5-7-18(8-6-17)28-19-11-15(10-16(12-19)23(25)26)22-21(24)14-29-13-20-4-3-9-30-20/h3-12H,2,13-14H2,1H3,(H,22,24)