N-[4-bromanyl-2-(2-chlorophenyl)carbonyl-phenyl]-1-thiophen-2-ylsulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[4-bromanyl-2-(2-chlorophenyl)carbonyl-phenyl]-1-thiophen-2-ylsulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-[4-bromo-2-(2-chlorobenzoyl)phenyl]-1-(2-thienylsulfonyl)pyrrolidine-2-carboxamide CAS Name: N-[4-bromo-2-[(2-chlorophenyl)-oxomethyl]phenyl]-1-thiophen-2-ylsulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-[4-bromo-2-(2-chlorobenzoyl)phenyl]-1-thiophen-2-ylsulfonylpyrrolidine-2-carboxamide Traditional Name: N-[4-bromo-2-(2-chlorobenzoyl)phenyl]-1-(2-thienylsulfonyl)pyrrolidine-2-carboxamide Formula: C22H18BrClN2O4S2 MolecularWeight: 553.87632

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=CS2)C(=O)NC3=C(C=C(C=C3)Br)C(=O)C4=CC=CC=C4Cl

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=CS2)C(=O)NC3=C(C=C(C=C3)Br)C(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C22H18BrClN2O4S2/c23-14-9-10-18(16(13-14)21(27)15-5-1-2-6-17(15)24)25-22(28)19-7-3-11-26(19)32(29,30)20-8-4-12-31-20/h1-2,4-6,8-10,12-13,19H,3,7,11H2,(H,25,28)