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

Systemtic Name: N-[2-[4-ethoxy-3-(methylcarbamothioylsulfamoyl)phenyl]ethyl]quinoline-3-carboxamide Openeye Name: N-[2-[4-ethoxy-3-(methylcarbamothioylsulfamoyl)phenyl]ethyl]quinoline-3-carboxamide CAS Name: N-[2-[4-ethoxy-3-[[methylamino(sulfanylidene)methyl]sulfamoyl]phenyl]ethyl]-3-quinolinecarboxamide IUPAC Name: N-[2-[4-ethoxy-3-(methylcarbamothioylsulfamoyl)phenyl]ethyl]quinoline-3-carboxamide Traditional Name: N-[2-[4-ethoxy-3-(methylthiocarbamoylsulfamoyl)phenyl]ethyl]quinoline-3-carboxamide Formula: C22H24N4O4S2 MolecularWeight: 472.58036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)C2=CC3=CC=CC=C3N=C2)S(=O)(=O)NC(=S)NC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)C2=CC3=CC=CC=C3N=C2)S(=O)(=O)NC(=S)NC

InChI

InChI=1S/C22H24N4O4S2/c1-3-30-19-9-8-15(12-20(19)32(28,29)26-22(31)23-2)10-11-24-21(27)17-13-16-6-4-5-7-18(16)25-14-17/h4-9,12-14H,3,10-11H2,1-2H3,(H,24,27)(H2,23,26,31)