2-(4-bromophenyl)sulfanyl-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-(4-bromophenyl)sulfanyl-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-(4-bromophenyl)sulfanyl-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)acetamide CAS Name: 2-[(4-bromophenyl)thio]-N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(4-bromophenyl)sulfanyl-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(4-bromophenyl)thio]-N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)acetamide Formula: C20H23BrN2O4S2 MolecularWeight: 499.44162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CSC2=CC=C(C=C2)Br)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CSC2=CC=C(C=C2)Br)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H23BrN2O4S2/c1-2-27-18-10-7-16(13-19(18)29(25,26)23-11-3-4-12-23)22-20(24)14-28-17-8-5-15(21)6-9-17/h5-10,13H,2-4,11-12,14H2,1H3,(H,22,24)