N-[(4-fluorophenyl)methyl]-3-(2-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)propanamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-3-(2-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)propanamide Openeye Name: N-[(4-fluorophenyl)methyl]-3-(2-oxo-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)propanamide CAS Name: N-[(4-fluorophenyl)methyl]-3-[2-oxo-6-(1-pyrrolidinylsulfonyl)-1,3-benzoxazol-3-yl]propanamide IUPAC Name: N-[(4-fluorophenyl)methyl]-3-(2-oxo-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)propanamide Traditional Name: N-(4-fluorobenzyl)-3-(2-keto-6-pyrrolidinosulfonyl-1,3-benzoxazol-3-yl)propionamide Formula: C21H22FN3O5S MolecularWeight: 447.479883

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CCC(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CCC(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C21H22FN3O5S/c22-16-5-3-15(4-6-16)14-23-20(26)9-12-25-18-8-7-17(13-19(18)30-21(25)27)31(28,29)24-10-1-2-11-24/h3-8,13H,1-2,9-12,14H2,(H,23,26)