6-(4-ethoxyphenyl)-2-[(4-nitrophenyl)methylsulfanyl]-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 6-(4-ethoxyphenyl)-2-[(4-nitrophenyl)methylsulfanyl]-4-phenyl-pyridine-3-carbonitrile Openeye Name: 6-(4-ethoxyphenyl)-2-[(4-nitrophenyl)methylsulfanyl]-4-phenyl-pyridine-3-carbonitrile CAS Name: 6-(4-ethoxyphenyl)-2-[(4-nitrophenyl)methylthio]-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 6-(4-ethoxyphenyl)-2-[(4-nitrophenyl)methylsulfanyl]-4-phenylpyridine-3-carbonitrile Traditional Name: 2-[(4-nitrobenzyl)thio]-4-phenyl-6-p-phenetyl-nicotinonitrile Formula: C27H21N3O3S MolecularWeight: 467.53894

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H21N3O3S/c1-2-33-23-14-10-21(11-15-23)26-16-24(20-6-4-3-5-7-20)25(17-28)27(29-26)34-18-19-8-12-22(13-9-19)30(31)32/h3-16H,2,18H2,1H3