ethyl 2-[2-[3-cyano-6-(4-ethoxyphenyl)-4-phenyl-pyridin-2-yl]sulfanylethanoyl-(3-nitrophenyl)amino]ethanoate

Systemtic Name: ethyl 2-[2-[3-cyano-6-(4-ethoxyphenyl)-4-phenyl-pyridin-2-yl]sulfanylethanoyl-(3-nitrophenyl)amino]ethanoate Openeye Name: ethyl 2-(N-[2-[[3-cyano-6-(4-ethoxyphenyl)-4-phenyl-2-pyridyl]sulfanyl]acetyl]-3-nitro-anilino)acetate CAS Name: 2-(N-[2-[[3-cyano-6-(4-ethoxyphenyl)-4-phenyl-2-pyridinyl]thio]-1-oxoethyl]-3-nitroanilino)acetic acid ethyl ester IUPAC Name: ethyl 2-(N-[2-[3-cyano-6-(4-ethoxyphenyl)-4-phenylpyridin-2-yl]sulfanylacetyl]-3-nitroanilino)acetate Traditional Name: 2-(N-[2-[(3-cyano-4-phenyl-6-p-phenetyl-2-pyridyl)thio]acetyl]-3-nitro-anilino)acetic acid ethyl ester Formula: C32H28N4O6S MolecularWeight: 596.65292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC(=O)N(CC(=O)OCC)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC(=O)N(CC(=O)OCC)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C32H28N4O6S/c1-3-41-26-15-13-23(14-16-26)29-18-27(22-9-6-5-7-10-22)28(19-33)32(34-29)43-21-30(37)35(20-31(38)42-4-2)24-11-8-12-25(17-24)36(39)40/h5-18H,3-4,20-21H2,1-2H3