N-[2-[5-(2-acetamidopyridin-4-yl)-4-(4-fluorophenyl)-2-methylsulfanyl-imidazol-1-yl]ethyl]ethanamide

Systemtic Name: N-[2-[5-(2-acetamidopyridin-4-yl)-4-(4-fluorophenyl)-2-methylsulfanyl-imidazol-1-yl]ethyl]ethanamide Openeye Name: N-[2-[5-(2-acetamido-4-pyridyl)-4-(4-fluorophenyl)-2-methylsulfanyl-imidazol-1-yl]ethyl]acetamide CAS Name: N-[2-[5-(2-acetamido-4-pyridinyl)-4-(4-fluorophenyl)-2-(methylthio)-1-imidazolyl]ethyl]acetamide IUPAC Name: N-[2-[5-(2-acetamidopyridin-4-yl)-4-(4-fluorophenyl)-2-methylsulfanylimidazol-1-yl]ethyl]acetamide Traditional Name: N-[2-[5-(2-acetamido-4-pyridyl)-4-(4-fluorophenyl)-2-(methylthio)imidazol-1-yl]ethyl]acetamide Formula: C21H22FN5O2S MolecularWeight: 427.495083

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCN1C(=C(N=C1SC)C2=CC=C(C=C2)F)C3=CC(=NC=C3)NC(=O)C

Isomeric SMILES

CC(=O)NCCN1C(=C(N=C1SC)C2=CC=C(C=C2)F)C3=CC(=NC=C3)NC(=O)C

InChI

InChI=1S/C21H22FN5O2S/c1-13(28)23-10-11-27-20(16-8-9-24-18(12-16)25-14(2)29)19(26-21(27)30-3)15-4-6-17(22)7-5-15/h4-9,12H,10-11H2,1-3H3,(H,23,28)(H,24,25,29)