N-(4-fluoranyl-2-methyl-phenyl)-2-(7-oxidanylidenebenzo[a]phenalen-3-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-fluoranyl-2-methyl-phenyl)-2-(7-oxidanylidenebenzo[a]phenalen-3-yl)sulfanyl-ethanamide Openeye Name: N-(4-fluoro-2-methyl-phenyl)-2-(7-oxobenzo[a]phenalen-3-yl)sulfanyl-acetamide CAS Name: N-(4-fluoro-2-methylphenyl)-2-[(7-oxo-3-benzo[a]phenalenyl)thio]acetamide IUPAC Name: N-(4-fluoro-2-methylphenyl)-2-(7-oxobenzo[a]phenalen-3-yl)sulfanylacetamide Traditional Name: N-(4-fluoro-2-methyl-phenyl)-2-[(7-ketobenzo[a]phenalen-3-yl)thio]acetamide Formula: C26H18FNO2S MolecularWeight: 427.490023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)NC(=O)CSC2=C3C=CC=C4C3=C(C=C2)C5=CC=CC=C5C4=O

Isomeric SMILES

CC1=C(C=CC(=C1)F)NC(=O)CSC2=C3C=CC=C4C3=C(C=C2)C5=CC=CC=C5C4=O

InChI

InChI=1S/C26H18FNO2S/c1-15-13-16(27)9-11-22(15)28-24(29)14-31-23-12-10-18-17-5-2-3-6-19(17)26(30)21-8-4-7-20(23)25(18)21/h2-13H,14H2,1H3,(H,28,29)