N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-4-chloranyl-3-(diethylsulfamoyl)benzamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-4-chloranyl-3-(diethylsulfamoyl)benzamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-4-chloro-3-(diethylsulfamoyl)benzamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-4-chloro-3-(diethylsulfamoyl)benzamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-4-chloro-3-(diethylsulfamoyl)benzamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-4-chloro-3-(diethylsulfamoyl)benzamide Formula: C22H27ClN4O3S2 MolecularWeight: 495.05778

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)NC(CCSC)C2=NC3=CC=CC=C3N2)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)NC(CCSC)C2=NC3=CC=CC=C3N2)Cl

InChI

InChI=1S/C22H27ClN4O3S2/c1-4-27(5-2)32(29,30)20-14-15(10-11-16(20)23)22(28)26-19(12-13-31-3)21-24-17-8-6-7-9-18(17)25-21/h6-11,14,19H,4-5,12-13H2,1-3H3,(H,24,25)(H,26,28)