2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-cyclopropyl-4-(4-fluorophenyl)pyridine-3-carbonitrile

Systemtic Name: 2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-cyclopropyl-4-(4-fluorophenyl)pyridine-3-carbonitrile Openeye Name: 2-[2-(4-bromophenyl)-2-oxo-ethyl]sulfanyl-6-cyclopropyl-4-(4-fluorophenyl)pyridine-3-carbonitrile CAS Name: 2-[[2-(4-bromophenyl)-2-oxoethyl]thio]-6-cyclopropyl-4-(4-fluorophenyl)-3-pyridinecarbonitrile IUPAC Name: 2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-6-cyclopropyl-4-(4-fluorophenyl)pyridine-3-carbonitrile Traditional Name: 2-[[2-(4-bromophenyl)-2-keto-ethyl]thio]-6-cyclopropyl-4-(4-fluorophenyl)nicotinonitrile Formula: C23H16BrFN2OS MolecularWeight: 467.353343

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=C(C(=C2)C3=CC=C(C=C3)F)C#N)SCC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CC1C2=NC(=C(C(=C2)C3=CC=C(C=C3)F)C#N)SCC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H16BrFN2OS/c24-17-7-3-16(4-8-17)22(28)13-29-23-20(12-26)19(11-21(27-23)15-1-2-15)14-5-9-18(25)10-6-14/h3-11,15H,1-2,13H2