N-[2-[4-(furan-2-yl)-3-(methylcarbamothioylsulfamoyl)phenyl]ethyl]quinoline-3-carboxamide

Systemtic Name: N-[2-[4-(furan-2-yl)-3-(methylcarbamothioylsulfamoyl)phenyl]ethyl]quinoline-3-carboxamide Openeye Name: N-[2-[4-(2-furyl)-3-(methylcarbamothioylsulfamoyl)phenyl]ethyl]quinoline-3-carboxamide CAS Name: N-[2-[4-(2-furanyl)-3-[[methylamino(sulfanylidene)methyl]sulfamoyl]phenyl]ethyl]-3-quinolinecarboxamide IUPAC Name: N-[2-[4-(furan-2-yl)-3-(methylcarbamothioylsulfamoyl)phenyl]ethyl]quinoline-3-carboxamide Traditional Name: N-[2-[4-(2-furyl)-3-(methylthiocarbamoylsulfamoyl)phenyl]ethyl]quinoline-3-carboxamide Formula: C24H22N4O4S2 MolecularWeight: 494.58588

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NS(=O)(=O)C1=C(C=CC(=C1)CCNC(=O)C2=CC3=CC=CC=C3N=C2)C4=CC=CO4

Isomeric SMILES

CNC(=S)NS(=O)(=O)C1=C(C=CC(=C1)CCNC(=O)C2=CC3=CC=CC=C3N=C2)C4=CC=CO4

InChI

InChI=1S/C24H22N4O4S2/c1-25-24(33)28-34(30,31)22-13-16(8-9-19(22)21-7-4-12-32-21)10-11-26-23(29)18-14-17-5-2-3-6-20(17)27-15-18/h2-9,12-15H,10-11H2,1H3,(H,26,29)(H2,25,28,33)