2-(4-bromanylpyrazol-1-yl)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-(4-bromanylpyrazol-1-yl)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-(4-bromopyrazol-1-yl)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)acetamide CAS Name: 2-(4-bromo-1-pyrazolyl)-N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(4-bromopyrazol-1-yl)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(4-bromopyrazol-1-yl)-N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)acetamide Formula: C17H21BrN4O4S MolecularWeight: 457.34204

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CN2C=C(C=N2)Br)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CN2C=C(C=N2)Br)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C17H21BrN4O4S/c1-2-26-15-6-5-14(20-17(23)12-21-11-13(18)10-19-21)9-16(15)27(24,25)22-7-3-4-8-22/h5-6,9-11H,2-4,7-8,12H2,1H3,(H,20,23)