2-bromanyl-N-(2-pyridin-2-ylethyl)-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-bromanyl-N-(2-pyridin-2-ylethyl)-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-bromo-N-[2-(2-pyridyl)ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-bromo-N-[2-(2-pyridinyl)ethyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-bromo-N-(2-pyridin-2-ylethyl)-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-bromo-N-[2-(2-pyridyl)ethyl]-5-pyrrolidinosulfonyl-benzamide Formula: C18H20BrN3O3S MolecularWeight: 438.3387

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NCCC3=CC=CC=N3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NCCC3=CC=CC=N3

InChI

InChI=1S/C18H20BrN3O3S/c19-17-7-6-15(26(24,25)22-11-3-4-12-22)13-16(17)18(23)21-10-8-14-5-1-2-9-20-14/h1-2,5-7,9,13H,3-4,8,10-12H2,(H,21,23)