5-chloranyl-2-methoxy-N-[2-[3-(methylcarbamothioylsulfamoyl)-4-pyridin-3-yl-phenyl]ethyl]benzamide

Systemtic Name: 5-chloranyl-2-methoxy-N-[2-[3-(methylcarbamothioylsulfamoyl)-4-pyridin-3-yl-phenyl]ethyl]benzamide Openeye Name: 5-chloro-2-methoxy-N-[2-[3-(methylcarbamothioylsulfamoyl)-4-(3-pyridyl)phenyl]ethyl]benzamide CAS Name: 5-chloro-2-methoxy-N-[2-[3-[[methylamino(sulfanylidene)methyl]sulfamoyl]-4-(3-pyridinyl)phenyl]ethyl]benzamide IUPAC Name: 5-chloro-2-methoxy-N-[2-[3-(methylcarbamothioylsulfamoyl)-4-pyridin-3-ylphenyl]ethyl]benzamide Traditional Name: 5-chloro-2-methoxy-N-[2-[3-(methylthiocarbamoylsulfamoyl)-4-(3-pyridyl)phenyl]ethyl]benzamide Formula: C23H23ClN4O4S2 MolecularWeight: 519.03612

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NS(=O)(=O)C1=C(C=CC(=C1)CCNC(=O)C2=C(C=CC(=C2)Cl)OC)C3=CN=CC=C3

Isomeric SMILES

CNC(=S)NS(=O)(=O)C1=C(C=CC(=C1)CCNC(=O)C2=C(C=CC(=C2)Cl)OC)C3=CN=CC=C3

InChI

InChI=1S/C23H23ClN4O4S2/c1-25-23(33)28-34(30,31)21-12-15(5-7-18(21)16-4-3-10-26-14-16)9-11-27-22(29)19-13-17(24)6-8-20(19)32-2/h3-8,10,12-14H,9,11H2,1-2H3,(H,27,29)(H2,25,28,33)