2-[(4-methylsulfanyl-3-pyrrolidin-1-ylcarbonyl-phenyl)sulfonylamino]-N-prop-2-enyl-benzamide

Systemtic Name: 2-[(4-methylsulfanyl-3-pyrrolidin-1-ylcarbonyl-phenyl)sulfonylamino]-N-prop-2-enyl-benzamide Openeye Name: N-allyl-2-[[4-methylsulfanyl-3-(pyrrolidine-1-carbonyl)phenyl]sulfonylamino]benzamide CAS Name: 2-[[4-(methylthio)-3-[oxo(1-pyrrolidinyl)methyl]phenyl]sulfonylamino]-N-prop-2-enylbenzamide IUPAC Name: 2-[[4-methylsulfanyl-3-(pyrrolidine-1-carbonyl)phenyl]sulfonylamino]-N-prop-2-enylbenzamide Traditional Name: N-allyl-2-[[4-(methylthio)-3-(pyrrolidine-1-carbonyl)phenyl]sulfonylamino]benzamide Formula: C22H25N3O4S2 MolecularWeight: 459.5816

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)NCC=C)C(=O)N3CCCC3

Isomeric SMILES

CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)NCC=C)C(=O)N3CCCC3

InChI

InChI=1S/C22H25N3O4S2/c1-3-12-23-21(26)17-8-4-5-9-19(17)24-31(28,29)16-10-11-20(30-2)18(15-16)22(27)25-13-6-7-14-25/h3-5,8-11,15,24H,1,6-7,12-14H2,2H3,(H,23,26)