N-[2-(4-fluorophenyl)-2-pyrrolidin-1-yl-ethyl]-3-methyl-2-oxidanylidene-1,3-benzoxazole-6-sulfonamide

Systemtic Name: N-[2-(4-fluorophenyl)-2-pyrrolidin-1-yl-ethyl]-3-methyl-2-oxidanylidene-1,3-benzoxazole-6-sulfonamide Openeye Name: N-[2-(4-fluorophenyl)-2-pyrrolidin-1-yl-ethyl]-3-methyl-2-oxo-1,3-benzoxazole-6-sulfonamide CAS Name: N-[2-(4-fluorophenyl)-2-(1-pyrrolidinyl)ethyl]-3-methyl-2-oxo-1,3-benzoxazole-6-sulfonamide IUPAC Name: N-[2-(4-fluorophenyl)-2-pyrrolidin-1-ylethyl]-3-methyl-2-oxo-1,3-benzoxazole-6-sulfonamide Traditional Name: N-[2-(4-fluorophenyl)-2-pyrrolidino-ethyl]-2-keto-3-methyl-1,3-benzoxazole-6-sulfonamide Formula: C20H22FN3O4S MolecularWeight: 419.469783

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)NCC(C3=CC=C(C=C3)F)N4CCCC4)OC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)NCC(C3=CC=C(C=C3)F)N4CCCC4)OC1=O

InChI

InChI=1S/C20H22FN3O4S/c1-23-17-9-8-16(12-19(17)28-20(23)25)29(26,27)22-13-18(24-10-2-3-11-24)14-4-6-15(21)7-5-14/h4-9,12,18,22H,2-3,10-11,13H2,1H3