N-[2-methoxy-4-[[3-methoxy-4-(2-pyridin-2-ylsulfanylethanoylamino)phenyl]methyl]phenyl]-2-pyridin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[2-methoxy-4-[[3-methoxy-4-(2-pyridin-2-ylsulfanylethanoylamino)phenyl]methyl]phenyl]-2-pyridin-2-ylsulfanyl-ethanamide Openeye Name: N-[2-methoxy-4-[[3-methoxy-4-[[2-(2-pyridylsulfanyl)acetyl]amino]phenyl]methyl]phenyl]-2-(2-pyridylsulfanyl)acetamide CAS Name: N-[2-methoxy-4-[[3-methoxy-4-[[1-oxo-2-(2-pyridinylthio)ethyl]amino]phenyl]methyl]phenyl]-2-(2-pyridinylthio)acetamide IUPAC Name: N-[2-methoxy-4-[[3-methoxy-4-[(2-pyridin-2-ylsulfanylacetyl)amino]phenyl]methyl]phenyl]-2-pyridin-2-ylsulfanylacetamide Traditional Name: N-[2-methoxy-4-[3-methoxy-4-[[2-(2-pyridylthio)acetyl]amino]benzyl]phenyl]-2-(2-pyridylthio)acetamide Formula: C29H28N4O4S2 MolecularWeight: 560.68702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC2=CC(=C(C=C2)NC(=O)CSC3=CC=CC=N3)OC)NC(=O)CSC4=CC=CC=N4

Isomeric SMILES

COC1=C(C=CC(=C1)CC2=CC(=C(C=C2)NC(=O)CSC3=CC=CC=N3)OC)NC(=O)CSC4=CC=CC=N4

InChI

InChI=1S/C29H28N4O4S2/c1-36-24-16-20(9-11-22(24)32-26(34)18-38-28-7-3-5-13-30-28)15-21-10-12-23(25(17-21)37-2)33-27(35)19-39-29-8-4-6-14-31-29/h3-14,16-17H,15,18-19H2,1-2H3,(H,32,34)(H,33,35)