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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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