N-butan-2-yl-5-methylsulfanyl-3-[[4-[2-(propylcarbamoylsulfamoyl)phenyl]phenyl]methyl]imidazole-4-carboxamide

Systemtic Name: N-butan-2-yl-5-methylsulfanyl-3-[[4-[2-(propylcarbamoylsulfamoyl)phenyl]phenyl]methyl]imidazole-4-carboxamide Openeye Name: 5-methylsulfanyl-3-[[4-[2-(propylcarbamoylsulfamoyl)phenyl]phenyl]methyl]-N-sec-butyl-imidazole-4-carboxamide CAS Name: N-butan-2-yl-5-(methylthio)-3-[[4-[2-[[oxo(propylamino)methyl]sulfamoyl]phenyl]phenyl]methyl]-4-imidazolecarboxamide IUPAC Name: N-butan-2-yl-5-methylsulfanyl-3-[[4-[2-(propylcarbamoylsulfamoyl)phenyl]phenyl]methyl]imidazole-4-carboxamide Traditional Name: 5-(methylthio)-3-[4-[2-(propylcarbamoylsulfamoyl)phenyl]benzyl]-N-sec-butyl-imidazole-4-carboxamide Formula: C26H33N5O4S2 MolecularWeight: 543.70132

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NS(=O)(=O)C1=CC=CC=C1C2=CC=C(C=C2)CN3C=NC(=C3C(=O)NC(C)CC)SC

Isomeric SMILES

CCCNC(=O)NS(=O)(=O)C1=CC=CC=C1C2=CC=C(C=C2)CN3C=NC(=C3C(=O)NC(C)CC)SC

InChI

InChI=1S/C26H33N5O4S2/c1-5-15-27-26(33)30-37(34,35)22-10-8-7-9-21(22)20-13-11-19(12-14-20)16-31-17-28-25(36-4)23(31)24(32)29-18(3)6-2/h7-14,17-18H,5-6,15-16H2,1-4H3,(H,29,32)(H2,27,30,33)