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

Systemtic Name: 3,4-dimethoxy-N-[4-[2-oxidanylidene-2-(pyridin-4-ylamino)ethyl]sulfanylphenyl]benzamide Openeye Name: 3,4-dimethoxy-N-[4-[2-oxo-2-(4-pyridylamino)ethyl]sulfanylphenyl]benzamide CAS Name: 3,4-dimethoxy-N-[4-[[2-oxo-2-(pyridin-4-ylamino)ethyl]thio]phenyl]benzamide IUPAC Name: 3,4-dimethoxy-N-[4-[2-oxo-2-(pyridin-4-ylamino)ethyl]sulfanylphenyl]benzamide Traditional Name: N-[4-[[2-keto-2-(4-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=NC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)SCC(=O)NC3=CC=NC=C3)OC

InChI

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