N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-homoveratryl-2-(methylthio)nicotinamide Formula: C17H20N2O3S MolecularWeight: 332.4173

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=C(N=CC=C2)SC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=C(N=CC=C2)SC)OC

InChI

InChI=1S/C17H20N2O3S/c1-21-14-7-6-12(11-15(14)22-2)8-10-18-16(20)13-5-4-9-19-17(13)23-3/h4-7,9,11H,8,10H2,1-3H3,(H,18,20)