2,3,4-trimethoxy-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzamide

Systemtic Name: 2,3,4-trimethoxy-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzamide Openeye Name: 2,3,4-trimethoxy-N-[4-(3-pyridylmethylsulfanyl)phenyl]benzamide CAS Name: 2,3,4-trimethoxy-N-[4-(3-pyridinylmethylthio)phenyl]benzamide IUPAC Name: 2,3,4-trimethoxy-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzamide Traditional Name: 2,3,4-trimethoxy-N-[4-(3-pyridylmethylthio)phenyl]benzamide Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3)OC)OC

InChI

InChI=1S/C22H22N2O4S/c1-26-19-11-10-18(20(27-2)21(19)28-3)22(25)24-16-6-8-17(9-7-16)29-14-15-5-4-12-23-13-15/h4-13H,14H2,1-3H3,(H,24,25)