2-[3-(4-fluorophenyl)-3-oxidanylidene-propyl]sulfanyl-4,6-dithiophen-2-yl-pyridine-3-carbonitrile

Systemtic Name: 2-[3-(4-fluorophenyl)-3-oxidanylidene-propyl]sulfanyl-4,6-dithiophen-2-yl-pyridine-3-carbonitrile Openeye Name: 2-[3-(4-fluorophenyl)-3-oxo-propyl]sulfanyl-4,6-bis(2-thienyl)pyridine-3-carbonitrile CAS Name: 2-[[3-(4-fluorophenyl)-3-oxopropyl]thio]-4,6-dithiophen-2-yl-3-pyridinecarbonitrile IUPAC Name: 2-[3-(4-fluorophenyl)-3-oxopropyl]sulfanyl-4,6-dithiophen-2-ylpyridine-3-carbonitrile Traditional Name: 2-[[3-(4-fluorophenyl)-3-keto-propyl]thio]-4,6-bis(2-thienyl)nicotinonitrile Formula: C23H15FN2OS3 MolecularWeight: 450.571403

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H15FN2OS3/c24-16-7-5-15(6-8-16)20(27)9-12-30-23-18(14-25)17(21-3-1-10-28-21)13-19(26-23)22-4-2-11-29-22/h1-8,10-11,13H,9,12H2