N-[4-(3,4-dimethylphenyl)sulfanylphenyl]-2-ethoxy-pyridine-3-carboxamide

Systemtic Name: N-[4-(3,4-dimethylphenyl)sulfanylphenyl]-2-ethoxy-pyridine-3-carboxamide Openeye Name: N-[4-(3,4-dimethylphenyl)sulfanylphenyl]-2-ethoxy-pyridine-3-carboxamide CAS Name: N-[4-[(3,4-dimethylphenyl)thio]phenyl]-2-ethoxy-3-pyridinecarboxamide IUPAC Name: N-[4-(3,4-dimethylphenyl)sulfanylphenyl]-2-ethoxypyridine-3-carboxamide Traditional Name: N-[4-[(3,4-dimethylphenyl)thio]phenyl]-2-ethoxy-nicotinamide Formula: C22H22N2O2S MolecularWeight: 378.48728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)C(=O)NC2=CC=C(C=C2)SC3=CC(=C(C=C3)C)C

Isomeric SMILES

CCOC1=C(C=CC=N1)C(=O)NC2=CC=C(C=C2)SC3=CC(=C(C=C3)C)C

InChI

InChI=1S/C22H22N2O2S/c1-4-26-22-20(6-5-13-23-22)21(25)24-17-8-11-18(12-9-17)27-19-10-7-15(2)16(3)14-19/h5-14H,4H2,1-3H3,(H,24,25)