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

Systemtic Name: 5-(2-fluorophenyl)-2-[1-(phenylmethyl)sulfonylpyrrolidin-2-yl]-1,3-benzoxazole Openeye Name: 2-(1-benzylsulfonylpyrrolidin-2-yl)-5-(2-fluorophenyl)-1,3-benzoxazole CAS Name: 5-(2-fluorophenyl)-2-[1-(phenylmethyl)sulfonyl-2-pyrrolidinyl]-1,3-benzoxazole IUPAC Name: 2-(1-benzylsulfonylpyrrolidin-2-yl)-5-(2-fluorophenyl)-1,3-benzoxazole Traditional Name: 2-(1-benzylsulfonylpyrrolidin-2-yl)-5-(2-fluorophenyl)-1,3-benzoxazole Formula: C24H21FN2O3S MolecularWeight: 436.498543

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)CC2=CC=CC=C2)C3=NC4=C(O3)C=CC(=C4)C5=CC=CC=C5F

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)CC2=CC=CC=C2)C3=NC4=C(O3)C=CC(=C4)C5=CC=CC=C5F

InChI

InChI=1S/C24H21FN2O3S/c25-20-10-5-4-9-19(20)18-12-13-23-21(15-18)26-24(30-23)22-11-6-14-27(22)31(28,29)16-17-7-2-1-3-8-17/h1-5,7-10,12-13,15,22H,6,11,14,16H2