N-(3,4-dimethoxyphenyl)-2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanyl-propanamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanyl-propanamide Openeye Name: N-(3,4-dimethoxyphenyl)-2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanyl-propanamide CAS Name: N-(3,4-dimethoxyphenyl)-2-[[1-(3-fluorophenyl)-2-imidazolyl]thio]propanamide IUPAC Name: N-(3,4-dimethoxyphenyl)-2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylpropanamide Traditional Name: N-(3,4-dimethoxyphenyl)-2-[[1-(3-fluorophenyl)imidazol-2-yl]thio]propionamide Formula: C20H20FN3O3S MolecularWeight: 401.454503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)OC)OC)SC2=NC=CN2C3=CC(=CC=C3)F

Isomeric SMILES

CC(C(=O)NC1=CC(=C(C=C1)OC)OC)SC2=NC=CN2C3=CC(=CC=C3)F

InChI

InChI=1S/C20H20FN3O3S/c1-13(19(25)23-15-7-8-17(26-2)18(12-15)27-3)28-20-22-9-10-24(20)16-6-4-5-14(21)11-16/h4-13H,1-3H3,(H,23,25)