2-[5-(3-fluorophenyl)sulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)imidazol-2-yl]ethyl ethanoate

Systemtic Name: 2-[5-(3-fluorophenyl)sulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)imidazol-2-yl]ethyl ethanoate Openeye Name: 2-[5-(3-fluorophenyl)sulfanyl-4-isopropyl-1-(4-pyridylmethyl)imidazol-2-yl]ethyl acetate CAS Name: acetic acid 2-[5-[(3-fluorophenyl)thio]-4-propan-2-yl-1-(pyridin-4-ylmethyl)-2-imidazolyl]ethyl ester IUPAC Name: 2-[5-(3-fluorophenyl)sulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)imidazol-2-yl]ethyl acetate Traditional Name: acetic acid 2-[5-[(3-fluorophenyl)thio]-4-isopropyl-1-(4-pyridylmethyl)imidazol-2-yl]ethyl ester Formula: C22H24FN3O2S MolecularWeight: 413.508263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(C(=N1)CCOC(=O)C)CC2=CC=NC=C2)SC3=CC=CC(=C3)F

Isomeric SMILES

CC(C)C1=C(N(C(=N1)CCOC(=O)C)CC2=CC=NC=C2)SC3=CC=CC(=C3)F

InChI

InChI=1S/C22H24FN3O2S/c1-15(2)21-22(29-19-6-4-5-18(23)13-19)26(14-17-7-10-24-11-8-17)20(25-21)9-12-28-16(3)27/h4-8,10-11,13,15H,9,12,14H2,1-3H3