2-[(4-fluoranylphenoxy)methyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[(4-fluoranylphenoxy)methyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[(4-fluorophenoxy)methyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)thiazole-4-carboxamide CAS Name: 2-[(4-fluorophenoxy)methyl]-N-[3-(1-pyrrolidinylsulfonyl)phenyl]-4-thiazolecarboxamide IUPAC Name: 2-[(4-fluorophenoxy)methyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[(4-fluorophenoxy)methyl]-N-(3-pyrrolidinosulfonylphenyl)thiazole-4-carboxamide Formula: C21H20FN3O4S2 MolecularWeight: 461.529603

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CSC(=N3)COC4=CC=C(C=C4)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CSC(=N3)COC4=CC=C(C=C4)F

InChI

InChI=1S/C21H20FN3O4S2/c22-15-6-8-17(9-7-15)29-13-20-24-19(14-30-20)21(26)23-16-4-3-5-18(12-16)31(27,28)25-10-1-2-11-25/h3-9,12,14H,1-2,10-11,13H2,(H,23,26)