N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-(cyclopropylsulfamoyl)-2-methyl-benzamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-(cyclopropylsulfamoyl)-2-methyl-benzamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-(cyclopropylsulfamoyl)-2-methyl-benzamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-5-(cyclopropylsulfamoyl)-2-methylbenzamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-5-(cyclopropylsulfamoyl)-2-methylbenzamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-5-(cyclopropylsulfamoyl)-2-methyl-benzamide Formula: C22H26N4O3S2 MolecularWeight: 458.59684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)C(=O)NC(CCSC)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)C(=O)NC(CCSC)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C22H26N4O3S2/c1-14-7-10-16(31(28,29)26-15-8-9-15)13-17(14)22(27)25-20(11-12-30-2)21-23-18-5-3-4-6-19(18)24-21/h3-7,10,13,15,20,26H,8-9,11-12H2,1-2H3,(H,23,24)(H,25,27)