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

Systemtic Name: N-[4-[(4-methylsulfanyl-3-pyrrolidin-1-ylcarbonyl-phenyl)sulfonylamino]phenyl]ethanamide Openeye Name: N-[4-[[4-methylsulfanyl-3-(pyrrolidine-1-carbonyl)phenyl]sulfonylamino]phenyl]acetamide CAS Name: N-[4-[[4-(methylthio)-3-[oxo(1-pyrrolidinyl)methyl]phenyl]sulfonylamino]phenyl]acetamide IUPAC Name: N-[4-[[4-methylsulfanyl-3-(pyrrolidine-1-carbonyl)phenyl]sulfonylamino]phenyl]acetamide Traditional Name: N-[4-[[4-(methylthio)-3-(pyrrolidine-1-carbonyl)phenyl]sulfonylamino]phenyl]acetamide Formula: C20H23N3O4S2 MolecularWeight: 433.54432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)SC)C(=O)N3CCCC3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)SC)C(=O)N3CCCC3

InChI

InChI=1S/C20H23N3O4S2/c1-14(24)21-15-5-7-16(8-6-15)22-29(26,27)17-9-10-19(28-2)18(13-17)20(25)23-11-3-4-12-23/h5-10,13,22H,3-4,11-12H2,1-2H3,(H,21,24)