2-(2,5-dimethoxyphenyl)sulfanyl-N-hexyl-pyridine-3-carboxamide

Systemtic Name: 2-(2,5-dimethoxyphenyl)sulfanyl-N-hexyl-pyridine-3-carboxamide Openeye Name: 2-(2,5-dimethoxyphenyl)sulfanyl-N-hexyl-pyridine-3-carboxamide CAS Name: 2-[(2,5-dimethoxyphenyl)thio]-N-hexyl-3-pyridinecarboxamide IUPAC Name: 2-(2,5-dimethoxyphenyl)sulfanyl-N-hexylpyridine-3-carboxamide Traditional Name: 2-[(2,5-dimethoxyphenyl)thio]-N-hexyl-nicotinamide Formula: C20H26N2O3S MolecularWeight: 374.49704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=C(N=CC=C1)SC2=C(C=CC(=C2)OC)OC

Isomeric SMILES

CCCCCCNC(=O)C1=C(N=CC=C1)SC2=C(C=CC(=C2)OC)OC

InChI

InChI=1S/C20H26N2O3S/c1-4-5-6-7-12-21-19(23)16-9-8-13-22-20(16)26-18-14-15(24-2)10-11-17(18)25-3/h8-11,13-14H,4-7,12H2,1-3H3,(H,21,23)