ethyl 2-[2-[3-cyano-4-(4-methoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanylethanoyl-(4-methyl-3-nitro-phenyl)amino]ethanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C1=CC(=C(C=C1)C)[N+](=O)[O-])C(=O)CSC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)OC)C#N

Isomeric SMILES

CCOC(=O)CN(C1=CC(=C(C=C1)C)[N+](=O)[O-])C(=O)CSC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)OC)C#N

InChI

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