2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-[[1-(3-fluorophenyl)-2-imidazolyl]thio]-N-[3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[[1-(3-fluorophenyl)imidazol-2-yl]thio]-N-(3-pyrrolidinosulfonylphenyl)acetamide Formula: C21H21FN4O3S2 MolecularWeight: 460.544843

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CSC3=NC=CN3C4=CC(=CC=C4)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CSC3=NC=CN3C4=CC(=CC=C4)F

InChI

InChI=1S/C21H21FN4O3S2/c22-16-5-3-7-18(13-16)26-12-9-23-21(26)30-15-20(27)24-17-6-4-8-19(14-17)31(28,29)25-10-1-2-11-25/h3-9,12-14H,1-2,10-11,15H2,(H,24,27)