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

Systemtic Name: 3-[5-(3-fluorophenyl)sulfanyl-1-methyl-4-propan-2-yl-imidazol-2-yl]propanoate Openeye Name: 3-[5-(3-fluorophenyl)sulfanyl-4-isopropyl-1-methyl-imidazol-2-yl]propanoate CAS Name: 3-[5-[(3-fluorophenyl)thio]-1-methyl-4-propan-2-yl-2-imidazolyl]propanoate IUPAC Name: 3-[5-(3-fluorophenyl)sulfanyl-1-methyl-4-propan-2-ylimidazol-2-yl]propanoate Traditional Name: 3-[5-[(3-fluorophenyl)thio]-4-isopropyl-1-methyl-imidazol-2-yl]propionate Formula: C16H18FN2O2S- MolecularWeight: 321.389723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(C(=N1)CCC(=O)[O-])C)SC2=CC=CC(=C2)F

Isomeric SMILES

CC(C)C1=C(N(C(=N1)CCC(=O)[O-])C)SC2=CC=CC(=C2)F

InChI

InChI=1S/C16H19FN2O2S/c1-10(2)15-16(22-12-6-4-5-11(17)9-12)19(3)13(18-15)7-8-14(20)21/h4-6,9-10H,7-8H2,1-3H3,(H,20,21)/p-1