2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]-1-[(4S)-4-fluoranylcyclohexa-1,5-dien-1-yl]ethanone

Systemtic Name: 2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]-1-[(4S)-4-fluoranylcyclohexa-1,5-dien-1-yl]ethanone Openeye Name: 2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]-1-[(4S)-4-fluorocyclohexa-1,5-dien-1-yl]ethanone CAS Name: 2-[(6-ethoxy-1H-benzimidazol-2-yl)thio]-1-[(4S)-4-fluoro-1-cyclohexa-1,5-dienyl]ethanone IUPAC Name: 2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]-1-[(4S)-4-fluorocyclohexa-1,5-dien-1-yl]ethanone Traditional Name: 2-[(6-ethoxy-1H-benzimidazol-2-yl)thio]-1-[(4S)-4-fluorocyclohexa-1,5-dien-1-yl]ethanone Formula: C17H17FN2O2S MolecularWeight: 332.392483

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(N2)SCC(=O)C3=CCC(C=C3)F

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(N2)SCC(=O)C3=CC[C@@H](C=C3)F

InChI

InChI=1S/C17H17FN2O2S/c1-2-22-13-7-8-14-15(9-13)20-17(19-14)23-10-16(21)11-3-5-12(18)6-4-11/h3-5,7-9,12H,2,6,10H2,1H3,(H,19,20)/t12-/m1/s1