3,4-dimethoxy-N-[4-[2-oxidanylidene-2-(pyridin-2-ylamino)ethyl]sulfanylphenyl]benzamide

Systemtic Name: 3,4-dimethoxy-N-[4-[2-oxidanylidene-2-(pyridin-2-ylamino)ethyl]sulfanylphenyl]benzamide Openeye Name: 3,4-dimethoxy-N-[4-[2-oxo-2-(2-pyridylamino)ethyl]sulfanylphenyl]benzamide CAS Name: 3,4-dimethoxy-N-[4-[[2-oxo-2-(2-pyridinylamino)ethyl]thio]phenyl]benzamide IUPAC Name: 3,4-dimethoxy-N-[4-[2-oxo-2-(pyridin-2-ylamino)ethyl]sulfanylphenyl]benzamide Traditional Name: N-[4-[[2-keto-2-(2-pyridylamino)ethyl]thio]phenyl]-3,4-dimethoxy-benzamide Formula: C22H21N3O4S MolecularWeight: 423.48484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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