5-(3-fluorophenyl)-2-[1-(4-methoxyphenyl)sulfonylpyrrolidin-2-yl]-1,3-benzoxazole

Systemtic Name: 5-(3-fluorophenyl)-2-[1-(4-methoxyphenyl)sulfonylpyrrolidin-2-yl]-1,3-benzoxazole Openeye Name: 5-(3-fluorophenyl)-2-[1-(4-methoxyphenyl)sulfonylpyrrolidin-2-yl]-1,3-benzoxazole CAS Name: 5-(3-fluorophenyl)-2-[1-(4-methoxyphenyl)sulfonyl-2-pyrrolidinyl]-1,3-benzoxazole IUPAC Name: 5-(3-fluorophenyl)-2-[1-(4-methoxyphenyl)sulfonylpyrrolidin-2-yl]-1,3-benzoxazole Traditional Name: 5-(3-fluorophenyl)-2-[1-(4-methoxyphenyl)sulfonylpyrrolidin-2-yl]-1,3-benzoxazole Formula: C24H21FN2O4S MolecularWeight: 452.497943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C3=NC4=C(O3)C=CC(=C4)C5=CC(=CC=C5)F

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C3=NC4=C(O3)C=CC(=C4)C5=CC(=CC=C5)F

InChI

InChI=1S/C24H21FN2O4S/c1-30-19-8-10-20(11-9-19)32(28,29)27-13-3-6-22(27)24-26-21-15-17(7-12-23(21)31-24)16-4-2-5-18(25)14-16/h2,4-5,7-12,14-15,22H,3,6,13H2,1H3