5-[3,3-diethyl-5-(4-methylsulfonylphenyl)cyclopenta-1,4-dien-1-yl]-2-fluoranyl-pyridine

Systemtic Name: 5-[3,3-diethyl-5-(4-methylsulfonylphenyl)cyclopenta-1,4-dien-1-yl]-2-fluoranyl-pyridine Openeye Name: 5-[3,3-diethyl-5-(4-methylsulfonylphenyl)cyclopenta-1,4-dien-1-yl]-2-fluoro-pyridine CAS Name: 5-[3,3-diethyl-5-(4-methylsulfonylphenyl)-1-cyclopenta-1,4-dienyl]-2-fluoropyridine IUPAC Name: 5-[3,3-diethyl-5-(4-methylsulfonylphenyl)cyclopenta-1,4-dien-1-yl]-2-fluoropyridine Traditional Name: 5-[3,3-diethyl-5-(4-mesylphenyl)cyclopenta-1,4-dien-1-yl]-2-fluoro-pyridine Formula: C21H22FNO2S MolecularWeight: 371.468283

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C=C(C(=C1)C2=CN=C(C=C2)F)C3=CC=C(C=C3)S(=O)(=O)C)CC

Isomeric SMILES

CCC1(C=C(C(=C1)C2=CN=C(C=C2)F)C3=CC=C(C=C3)S(=O)(=O)C)CC

InChI

InChI=1S/C21H22FNO2S/c1-4-21(5-2)12-18(15-6-9-17(10-7-15)26(3,24)25)19(13-21)16-8-11-20(22)23-14-16/h6-14H,4-5H2,1-3H3