N-[4-[5-(4-fluorophenyl)-2-methylsulfanyl-3-(2-prop-2-ynoxyethyl)imidazol-4-yl]pyridin-2-yl]ethanamide

Systemtic Name: N-[4-[5-(4-fluorophenyl)-2-methylsulfanyl-3-(2-prop-2-ynoxyethyl)imidazol-4-yl]pyridin-2-yl]ethanamide Openeye Name: N-[4-[5-(4-fluorophenyl)-2-methylsulfanyl-3-(2-prop-2-ynoxyethyl)imidazol-4-yl]-2-pyridyl]acetamide CAS Name: N-[4-[5-(4-fluorophenyl)-2-(methylthio)-3-(2-prop-2-ynoxyethyl)-4-imidazolyl]-2-pyridinyl]acetamide IUPAC Name: N-[4-[5-(4-fluorophenyl)-2-methylsulfanyl-3-(2-prop-2-ynoxyethyl)imidazol-4-yl]pyridin-2-yl]acetamide Traditional Name: N-[4-[5-(4-fluorophenyl)-2-(methylthio)-3-(2-propargyloxyethyl)imidazol-4-yl]-2-pyridyl]acetamide Formula: C22H21FN4O2S MolecularWeight: 424.491143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC=CC(=C1)C2=C(N=C(N2CCOCC#C)SC)C3=CC=C(C=C3)F

Isomeric SMILES

CC(=O)NC1=NC=CC(=C1)C2=C(N=C(N2CCOCC#C)SC)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H21FN4O2S/c1-4-12-29-13-11-27-21(17-9-10-24-19(14-17)25-15(2)28)20(26-22(27)30-3)16-5-7-18(23)8-6-16/h1,5-10,14H,11-13H2,2-3H3,(H,24,25,28)