7-(3-fluoranyl-5-phenyl-phenyl)sulfanyl-4-(1H-pyrrol-3-yl)chromen-2-one

Systemtic Name: 7-(3-fluoranyl-5-phenyl-phenyl)sulfanyl-4-(1H-pyrrol-3-yl)chromen-2-one Openeye Name: 7-(3-fluoro-5-phenyl-phenyl)sulfanyl-4-(1H-pyrrol-3-yl)chromen-2-one CAS Name: 7-[(3-fluoro-5-phenylphenyl)thio]-4-(1H-pyrrol-3-yl)-1-benzopyran-2-one IUPAC Name: 7-(3-fluoro-5-phenylphenyl)sulfanyl-4-(1H-pyrrol-3-yl)chromen-2-one Traditional Name: 7-[(3-fluoro-5-phenyl-phenyl)thio]-4-(1H-pyrrol-3-yl)coumarin Formula: C25H16FNO2S MolecularWeight: 413.463443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=CC(=C2)SC3=CC4=C(C=C3)C(=CC(=O)O4)C5=CNC=C5)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=CC(=C2)SC3=CC4=C(C=C3)C(=CC(=O)O4)C5=CNC=C5)F

InChI

InChI=1S/C25H16FNO2S/c26-19-10-18(16-4-2-1-3-5-16)11-21(12-19)30-20-6-7-22-23(17-8-9-27-15-17)14-25(28)29-24(22)13-20/h1-15,27H