N-[(5-methylthiophen-2-yl)methyl]-2-(2-nitropyridin-3-yl)oxy-N-phenethyl-ethanamide

Systemtic Name: N-[(5-methylthiophen-2-yl)methyl]-2-(2-nitropyridin-3-yl)oxy-N-phenethyl-ethanamide Openeye Name: N-[(5-methyl-2-thienyl)methyl]-2-[(2-nitro-3-pyridyl)oxy]-N-phenethyl-acetamide CAS Name: N-[(5-methyl-2-thiophenyl)methyl]-2-[(2-nitro-3-pyridinyl)oxy]-N-phenethylacetamide IUPAC Name: N-[(5-methylthiophen-2-yl)methyl]-2-(2-nitropyridin-3-yl)oxy-N-phenethylacetamide Traditional Name: N-[(5-methyl-2-thienyl)methyl]-2-[(2-nitro-3-pyridyl)oxy]-N-phenethyl-acetamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN(CCC2=CC=CC=C2)C(=O)COC3=C(N=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(S1)CN(CCC2=CC=CC=C2)C(=O)COC3=C(N=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O4S/c1-16-9-10-18(29-16)14-23(13-11-17-6-3-2-4-7-17)20(25)15-28-19-8-5-12-22-21(19)24(26)27/h2-10,12H,11,13-15H2,1H3