2-chloranyl-N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]-5-methylsulfanyl-benzamide

Systemtic Name: 2-chloranyl-N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]-5-methylsulfanyl-benzamide Openeye Name: 2-chloro-N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]-5-methylsulfanyl-benzamide CAS Name: 2-chloro-N-[5-(diethylsulfamoyl)-2-(1-pyrrolidinyl)phenyl]-5-(methylthio)benzamide IUPAC Name: 2-chloro-N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-ylphenyl]-5-methylsulfanylbenzamide Traditional Name: 2-chloro-N-[5-(diethylsulfamoyl)-2-pyrrolidino-phenyl]-5-(methylthio)benzamide Formula: C22H28ClN3O3S2 MolecularWeight: 482.05902

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=O)C3=C(C=CC(=C3)SC)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=O)C3=C(C=CC(=C3)SC)Cl

InChI

InChI=1S/C22H28ClN3O3S2/c1-4-26(5-2)31(28,29)17-9-11-21(25-12-6-7-13-25)20(15-17)24-22(27)18-14-16(30-3)8-10-19(18)23/h8-11,14-15H,4-7,12-13H2,1-3H3,(H,24,27)