2-bromanyl-N-(3-pyrazol-1-ylpropyl)-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-bromanyl-N-(3-pyrazol-1-ylpropyl)-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-bromo-N-(3-pyrazol-1-ylpropyl)-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-bromo-N-[3-(1-pyrazolyl)propyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-bromo-N-(3-pyrazol-1-ylpropyl)-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-bromo-N-(3-pyrazol-1-ylpropyl)-5-pyrrolidinosulfonyl-benzamide Formula: C17H21BrN4O3S MolecularWeight: 441.34264

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NCCCN3C=CC=N3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NCCCN3C=CC=N3

InChI

InChI=1S/C17H21BrN4O3S/c18-16-6-5-14(26(24,25)22-11-1-2-12-22)13-15(16)17(23)19-7-3-9-21-10-4-8-20-21/h4-6,8,10,13H,1-3,7,9,11-12H2,(H,19,23)