4-(3,4-dimethoxyphenyl)-2-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-pyridine-3-carbonitrile

Systemtic Name: 4-(3,4-dimethoxyphenyl)-2-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-pyridine-3-carbonitrile Openeye Name: 4-(3,4-dimethoxyphenyl)-2-[2-(4-nitrophenyl)-2-oxo-ethyl]sulfanyl-6-phenyl-pyridine-3-carbonitrile CAS Name: 4-(3,4-dimethoxyphenyl)-2-[[2-(4-nitrophenyl)-2-oxoethyl]thio]-6-phenyl-3-pyridinecarbonitrile IUPAC Name: 4-(3,4-dimethoxyphenyl)-2-[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl-6-phenylpyridine-3-carbonitrile Traditional Name: 4-(3,4-dimethoxyphenyl)-2-[[2-keto-2-(4-nitrophenyl)ethyl]thio]-6-phenyl-nicotinonitrile Formula: C28H21N3O5S MolecularWeight: 511.54844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4)OC

InChI

InChI=1S/C28H21N3O5S/c1-35-26-13-10-20(14-27(26)36-2)22-15-24(18-6-4-3-5-7-18)30-28(23(22)16-29)37-17-25(32)19-8-11-21(12-9-19)31(33)34/h3-15H,17H2,1-2H3