4-[(4-methylsulfanyl-3-pyrrolidin-1-ylcarbonyl-phenyl)sulfonylamino]benzamide

Systemtic Name: 4-[(4-methylsulfanyl-3-pyrrolidin-1-ylcarbonyl-phenyl)sulfonylamino]benzamide Openeye Name: 4-[[4-methylsulfanyl-3-(pyrrolidine-1-carbonyl)phenyl]sulfonylamino]benzamide CAS Name: 4-[[4-(methylthio)-3-[oxo(1-pyrrolidinyl)methyl]phenyl]sulfonylamino]benzamide IUPAC Name: 4-[[4-methylsulfanyl-3-(pyrrolidine-1-carbonyl)phenyl]sulfonylamino]benzamide Traditional Name: 4-[[4-(methylthio)-3-(pyrrolidine-1-carbonyl)phenyl]sulfonylamino]benzamide Formula: C19H21N3O4S2 MolecularWeight: 419.51774

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)N)C(=O)N3CCCC3

Isomeric SMILES

CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)N)C(=O)N3CCCC3

InChI

InChI=1S/C19H21N3O4S2/c1-27-17-9-8-15(12-16(17)19(24)22-10-2-3-11-22)28(25,26)21-14-6-4-13(5-7-14)18(20)23/h4-9,12,21H,2-3,10-11H2,1H3,(H2,20,23)