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

Systemtic Name: 2-[(2,4-dimethoxyphenyl)methylsulfanyl]-N-[2-(2-hydroxyethylamino)pyridin-4-yl]pyridine-3-carboxamide Openeye Name: 2-[(2,4-dimethoxyphenyl)methylsulfanyl]-N-[2-(2-hydroxyethylamino)-4-pyridyl]pyridine-3-carboxamide CAS Name: 2-[(2,4-dimethoxyphenyl)methylthio]-N-[2-(2-hydroxyethylamino)-4-pyridinyl]-3-pyridinecarboxamide IUPAC Name: 2-[(2,4-dimethoxyphenyl)methylsulfanyl]-N-[2-(2-hydroxyethylamino)pyridin-4-yl]pyridine-3-carboxamide Traditional Name: 2-[(2,4-dimethoxybenzyl)thio]-N-[2-(2-hydroxyethylamino)-4-pyridyl]nicotinamide Formula: C22H24N4O4S MolecularWeight: 440.51536

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O4S/c1-29-17-6-5-15(19(13-17)30-2)14-31-22-18(4-3-8-25-22)21(28)26-16-7-9-23-20(12-16)24-10-11-27/h3-9,12-13,27H,10-11,14H2,1-2H3,(H2,23,24,26,28)