2-[3-[(3-fluorophenyl)methylsulfonyl]indol-1-yl]-N-(3-imidazol-1-ylpropyl)ethanamide

Systemtic Name: 2-[3-[(3-fluorophenyl)methylsulfonyl]indol-1-yl]-N-(3-imidazol-1-ylpropyl)ethanamide Openeye Name: 2-[3-[(3-fluorophenyl)methylsulfonyl]indol-1-yl]-N-(3-imidazol-1-ylpropyl)acetamide CAS Name: 2-[3-[(3-fluorophenyl)methylsulfonyl]-1-indolyl]-N-[3-(1-imidazolyl)propyl]acetamide IUPAC Name: 2-[3-[(3-fluorophenyl)methylsulfonyl]indol-1-yl]-N-(3-imidazol-1-ylpropyl)acetamide Traditional Name: 2-[3-(3-fluorobenzyl)sulfonylindol-1-yl]-N-(3-imidazol-1-ylpropyl)acetamide Formula: C23H23FN4O3S MolecularWeight: 454.517123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CC(=O)NCCCN3C=CN=C3)S(=O)(=O)CC4=CC(=CC=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CC(=O)NCCCN3C=CN=C3)S(=O)(=O)CC4=CC(=CC=C4)F

InChI

InChI=1S/C23H23FN4O3S/c24-19-6-3-5-18(13-19)16-32(30,31)22-14-28(21-8-2-1-7-20(21)22)15-23(29)26-9-4-11-27-12-10-25-17-27/h1-3,5-8,10,12-14,17H,4,9,11,15-16H2,(H,26,29)