2,6-dimethoxy-N-[4-[2-oxidanylidene-2-(pyridin-2-ylamino)ethyl]sulfanylphenyl]benzamide

Systemtic Name: 2,6-dimethoxy-N-[4-[2-oxidanylidene-2-(pyridin-2-ylamino)ethyl]sulfanylphenyl]benzamide Openeye Name: 2,6-dimethoxy-N-[4-[2-oxo-2-(2-pyridylamino)ethyl]sulfanylphenyl]benzamide CAS Name: 2,6-dimethoxy-N-[4-[[2-oxo-2-(2-pyridinylamino)ethyl]thio]phenyl]benzamide IUPAC Name: 2,6-dimethoxy-N-[4-[2-oxo-2-(pyridin-2-ylamino)ethyl]sulfanylphenyl]benzamide Traditional Name: N-[4-[[2-keto-2-(2-pyridylamino)ethyl]thio]phenyl]-2,6-dimethoxy-benzamide Formula: C22H21N3O4S MolecularWeight: 423.48484

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(=O)NC2=CC=C(C=C2)SCC(=O)NC3=CC=CC=N3

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(=O)NC2=CC=C(C=C2)SCC(=O)NC3=CC=CC=N3

InChI

InChI=1S/C22H21N3O4S/c1-28-17-6-5-7-18(29-2)21(17)22(27)24-15-9-11-16(12-10-15)30-14-20(26)25-19-8-3-4-13-23-19/h3-13H,14H2,1-2H3,(H,24,27)(H,23,25,26)