2-(2,5-dimethoxyphenyl)sulfanyl-N-[1-(4-fluorophenyl)ethyl]pyridine-3-carboxamide

Systemtic Name: 2-(2,5-dimethoxyphenyl)sulfanyl-N-[1-(4-fluorophenyl)ethyl]pyridine-3-carboxamide Openeye Name: 2-(2,5-dimethoxyphenyl)sulfanyl-N-[1-(4-fluorophenyl)ethyl]pyridine-3-carboxamide CAS Name: 2-[(2,5-dimethoxyphenyl)thio]-N-[1-(4-fluorophenyl)ethyl]-3-pyridinecarboxamide IUPAC Name: 2-(2,5-dimethoxyphenyl)sulfanyl-N-[1-(4-fluorophenyl)ethyl]pyridine-3-carboxamide Traditional Name: 2-[(2,5-dimethoxyphenyl)thio]-N-[1-(4-fluorophenyl)ethyl]nicotinamide Formula: C22H21FN2O3S MolecularWeight: 412.477143

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21FN2O3S/c1-14(15-6-8-16(23)9-7-15)25-21(26)18-5-4-12-24-22(18)29-20-13-17(27-2)10-11-19(20)28-3/h4-14H,1-3H3,(H,25,26)