6-(3-fluoranyl-5-thiophen-3-yl-phenyl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one

Systemtic Name: 6-(3-fluoranyl-5-thiophen-3-yl-phenyl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one Openeye Name: 6-[3-fluoro-5-(3-thienyl)phenyl]-4,4-dimethyl-1H-3,1-benzoxazin-2-one CAS Name: 6-[3-fluoro-5-(3-thiophenyl)phenyl]-4,4-dimethyl-1H-3,1-benzoxazin-2-one IUPAC Name: 6-(3-fluoro-5-thiophen-3-ylphenyl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one Traditional Name: 6-[3-fluoro-5-(3-thienyl)phenyl]-4,4-dimethyl-1H-3,1-benzoxazin-2-one Formula: C20H16FNO2S MolecularWeight: 353.409943

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)C3=CC(=CC(=C3)F)C4=CSC=C4)NC(=O)O1)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2)C3=CC(=CC(=C3)F)C4=CSC=C4)NC(=O)O1)C

InChI

InChI=1S/C20H16FNO2S/c1-20(2)17-10-12(3-4-18(17)22-19(23)24-20)14-7-15(9-16(21)8-14)13-5-6-25-11-13/h3-11H,1-2H3,(H,22,23)