3-(2,1,3-benzothiadiazol-5-yl)-5-(3-fluoranyl-4-methoxy-phenyl)-5-oxidanyl-4-(phenylmethyl)furan-2-one

Systemtic Name: 3-(2,1,3-benzothiadiazol-5-yl)-5-(3-fluoranyl-4-methoxy-phenyl)-5-oxidanyl-4-(phenylmethyl)furan-2-one Openeye Name: 3-(2,1,3-benzothiadiazol-5-yl)-4-benzyl-5-(3-fluoro-4-methoxy-phenyl)-5-hydroxy-furan-2-one CAS Name: 3-(2,1,3-benzothiadiazol-5-yl)-5-(3-fluoro-4-methoxyphenyl)-5-hydroxy-4-(phenylmethyl)-2-furanone IUPAC Name: 3-(2,1,3-benzothiadiazol-5-yl)-4-benzyl-5-(3-fluoro-4-methoxyphenyl)-5-hydroxyfuran-2-one Traditional Name: 4-benzyl-5-(3-fluoro-4-methoxy-phenyl)-5-hydroxy-3-piazthiol-5-yl-furan-2-one Formula: C24H17FN2O4S MolecularWeight: 448.466183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(C(=C(C(=O)O2)C3=CC4=NSN=C4C=C3)CC5=CC=CC=C5)O)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2(C(=C(C(=O)O2)C3=CC4=NSN=C4C=C3)CC5=CC=CC=C5)O)F

InChI

InChI=1S/C24H17FN2O4S/c1-30-21-10-8-16(13-18(21)25)24(29)17(11-14-5-3-2-4-6-14)22(23(28)31-24)15-7-9-19-20(12-15)27-32-26-19/h2-10,12-13,29H,11H2,1H3