(2S)-1-(4-bromophenyl)sulfonyl-N-(2-thiophen-2-ylethyl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-(4-bromophenyl)sulfonyl-N-(2-thiophen-2-ylethyl)pyrrolidine-2-carboxamide Openeye Name: (2S)-1-(4-bromophenyl)sulfonyl-N-[2-(2-thienyl)ethyl]pyrrolidine-2-carboxamide CAS Name: (2S)-1-(4-bromophenyl)sulfonyl-N-(2-thiophen-2-ylethyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-(4-bromophenyl)sulfonyl-N-(2-thiophen-2-ylethyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-1-brosyl-N-[2-(2-thienyl)ethyl]pyrrolidine-2-carboxamide Formula: C17H19BrN2O3S2 MolecularWeight: 443.37836

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)Br)C(=O)NCCC3=CC=CS3

Isomeric SMILES

C1C[C@H](N(C1)S(=O)(=O)C2=CC=C(C=C2)Br)C(=O)NCCC3=CC=CS3

InChI

InChI=1S/C17H19BrN2O3S2/c18-13-5-7-15(8-6-13)25(22,23)20-11-1-4-16(20)17(21)19-10-9-14-3-2-12-24-14/h2-3,5-8,12,16H,1,4,9-11H2,(H,19,21)/t16-/m0/s1