6-chloranyl-2-[(2,4-dimethoxyphenyl)methylsulfanyl]-N-pyridin-4-yl-pyridine-3-carboxamide

Systemtic Name: 6-chloranyl-2-[(2,4-dimethoxyphenyl)methylsulfanyl]-N-pyridin-4-yl-pyridine-3-carboxamide Openeye Name: 6-chloro-2-[(2,4-dimethoxyphenyl)methylsulfanyl]-N-(4-pyridyl)pyridine-3-carboxamide CAS Name: 6-chloro-2-[(2,4-dimethoxyphenyl)methylthio]-N-pyridin-4-yl-3-pyridinecarboxamide IUPAC Name: 6-chloro-2-[(2,4-dimethoxyphenyl)methylsulfanyl]-N-pyridin-4-ylpyridine-3-carboxamide Traditional Name: 6-chloro-2-[(2,4-dimethoxybenzyl)thio]-N-(4-pyridyl)nicotinamide Formula: C20H18ClN3O3S MolecularWeight: 415.89322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CSC2=C(C=CC(=N2)Cl)C(=O)NC3=CC=NC=C3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CSC2=C(C=CC(=N2)Cl)C(=O)NC3=CC=NC=C3)OC

InChI

InChI=1S/C20H18ClN3O3S/c1-26-15-4-3-13(17(11-15)27-2)12-28-20-16(5-6-18(21)24-20)19(25)23-14-7-9-22-10-8-14/h3-11H,12H2,1-2H3,(H,22,23,25)