N-(5-bromanylpyridin-2-yl)-3-cyclopentyl-2-(4-methylsulfonyl-3-nitro-phenyl)propanamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-3-cyclopentyl-2-(4-methylsulfonyl-3-nitro-phenyl)propanamide Openeye Name: N-(5-bromo-2-pyridyl)-3-cyclopentyl-2-(4-methylsulfonyl-3-nitro-phenyl)propanamide CAS Name: N-(5-bromo-2-pyridinyl)-3-cyclopentyl-2-(4-methylsulfonyl-3-nitrophenyl)propanamide IUPAC Name: N-(5-bromopyridin-2-yl)-3-cyclopentyl-2-(4-methylsulfonyl-3-nitrophenyl)propanamide Traditional Name: N-(5-bromo-2-pyridyl)-3-cyclopentyl-2-(4-mesyl-3-nitro-phenyl)propionamide Formula: C20H22BrN3O5S MolecularWeight: 496.37478

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C=C1)C(CC2CCCC2)C(=O)NC3=NC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C=C1)C(CC2CCCC2)C(=O)NC3=NC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C20H22BrN3O5S/c1-30(28,29)18-8-6-14(11-17(18)24(26)27)16(10-13-4-2-3-5-13)20(25)23-19-9-7-15(21)12-22-19/h6-9,11-13,16H,2-5,10H2,1H3,(H,22,23,25)