2-(3-nitrophenoxy)-N-[4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]ethanamide

Systemtic Name: 2-(3-nitrophenoxy)-N-[4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]ethanamide Openeye Name: 2-(3-nitrophenoxy)-N-[4-(4-pyrrolidin-1-ylsulfonylphenyl)thiazol-2-yl]acetamide CAS Name: 2-(3-nitrophenoxy)-N-[4-[4-(1-pyrrolidinylsulfonyl)phenyl]-2-thiazolyl]acetamide IUPAC Name: 2-(3-nitrophenoxy)-N-[4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]acetamide Traditional Name: 2-(3-nitrophenoxy)-N-[4-(4-pyrrolidinosulfonylphenyl)thiazol-2-yl]acetamide Formula: C21H20N4O6S2 MolecularWeight: 488.5367

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=N3)NC(=O)COC4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=N3)NC(=O)COC4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O6S2/c26-20(13-31-17-5-3-4-16(12-17)25(27)28)23-21-22-19(14-32-21)15-6-8-18(9-7-15)33(29,30)24-10-1-2-11-24/h3-9,12,14H,1-2,10-11,13H2,(H,22,23,26)