2-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]sulfanyl-4-(4-methoxyphenyl)-6-thiophen-2-yl-pyridine-3-carbonitrile

Systemtic Name: 2-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]sulfanyl-4-(4-methoxyphenyl)-6-thiophen-2-yl-pyridine-3-carbonitrile Openeye Name: 2-[4-(4-fluorophenyl)-4-oxo-butyl]sulfanyl-4-(4-methoxyphenyl)-6-(2-thienyl)pyridine-3-carbonitrile CAS Name: 2-[[4-(4-fluorophenyl)-4-oxobutyl]thio]-4-(4-methoxyphenyl)-6-thiophen-2-yl-3-pyridinecarbonitrile IUPAC Name: 2-[4-(4-fluorophenyl)-4-oxobutyl]sulfanyl-4-(4-methoxyphenyl)-6-thiophen-2-ylpyridine-3-carbonitrile Traditional Name: 2-[[4-(4-fluorophenyl)-4-keto-butyl]thio]-4-(4-methoxyphenyl)-6-(2-thienyl)nicotinonitrile Formula: C27H21FN2O2S2 MolecularWeight: 488.596243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCCC(=O)C3=CC=C(C=C3)F)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCCC(=O)C3=CC=C(C=C3)F)C4=CC=CS4

InChI

InChI=1S/C27H21FN2O2S2/c1-32-21-12-8-18(9-13-21)22-16-24(26-5-3-14-33-26)30-27(23(22)17-29)34-15-2-4-25(31)19-6-10-20(28)11-7-19/h3,5-14,16H,2,4,15H2,1H3