2-[5-(4-fluorophenyl)-1-(phenylmethyl)imidazol-2-yl]sulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[5-(4-fluorophenyl)-1-(phenylmethyl)imidazol-2-yl]sulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[1-benzyl-5-(4-fluorophenyl)imidazol-2-yl]sulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-[[5-(4-fluorophenyl)-1-(phenylmethyl)-2-imidazolyl]thio]-N-[4-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[1-benzyl-5-(4-fluorophenyl)imidazol-2-yl]sulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[[1-benzyl-5-(4-fluorophenyl)imidazol-2-yl]thio]-N-(4-pyrrolidinosulfonylphenyl)acetamide Formula: C28H27FN4O3S2 MolecularWeight: 550.667383

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC=C(N3CC4=CC=CC=C4)C5=CC=C(C=C5)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC=C(N3CC4=CC=CC=C4)C5=CC=C(C=C5)F

InChI

InChI=1S/C28H27FN4O3S2/c29-23-10-8-22(9-11-23)26-18-30-28(33(26)19-21-6-2-1-3-7-21)37-20-27(34)31-24-12-14-25(15-13-24)38(35,36)32-16-4-5-17-32/h1-3,6-15,18H,4-5,16-17,19-20H2,(H,31,34)