4-(4-tert-butylphenyl)-2-[(4-fluorophenyl)sulfanylmethyl]-6-thiophen-2-yl-pyridine-3-carbonitrile

Systemtic Name: 4-(4-tert-butylphenyl)-2-[(4-fluorophenyl)sulfanylmethyl]-6-thiophen-2-yl-pyridine-3-carbonitrile Openeye Name: 4-(4-tert-butylphenyl)-2-[(4-fluorophenyl)sulfanylmethyl]-6-(2-thienyl)pyridine-3-carbonitrile CAS Name: 4-(4-tert-butylphenyl)-2-[[(4-fluorophenyl)thio]methyl]-6-thiophen-2-yl-3-pyridinecarbonitrile IUPAC Name: 4-(4-tert-butylphenyl)-2-[(4-fluorophenyl)sulfanylmethyl]-6-thiophen-2-ylpyridine-3-carbonitrile Traditional Name: 4-(4-tert-butylphenyl)-2-[[(4-fluorophenyl)thio]methyl]-6-(2-thienyl)nicotinonitrile Formula: C27H23FN2S2 MolecularWeight: 458.613323

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CC(=NC(=C2C#N)CSC3=CC=C(C=C3)F)C4=CC=CS4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CC(=NC(=C2C#N)CSC3=CC=C(C=C3)F)C4=CC=CS4

InChI

InChI=1S/C27H23FN2S2/c1-27(2,3)19-8-6-18(7-9-19)22-15-24(26-5-4-14-31-26)30-25(23(22)16-29)17-32-21-12-10-20(28)11-13-21/h4-15H,17H2,1-3H3