3-(5-bromanyl-3-cyclopentyl-pyrazin-2-yl)-N-(4-methylsulfonylphenyl)propanamide

Systemtic Name: 3-(5-bromanyl-3-cyclopentyl-pyrazin-2-yl)-N-(4-methylsulfonylphenyl)propanamide Openeye Name: 3-(5-bromo-3-cyclopentyl-pyrazin-2-yl)-N-(4-methylsulfonylphenyl)propanamide CAS Name: 3-(5-bromo-3-cyclopentyl-2-pyrazinyl)-N-(4-methylsulfonylphenyl)propanamide IUPAC Name: 3-(5-bromo-3-cyclopentylpyrazin-2-yl)-N-(4-methylsulfonylphenyl)propanamide Traditional Name: 3-(5-bromo-3-cyclopentyl-pyrazin-2-yl)-N-(4-mesylphenyl)propionamide Formula: C19H22BrN3O3S MolecularWeight: 452.36528

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)NC(=O)CCC2=NC=C(N=C2C3CCCC3)Br

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)NC(=O)CCC2=NC=C(N=C2C3CCCC3)Br

InChI

InChI=1S/C19H22BrN3O3S/c1-27(25,26)15-8-6-14(7-9-15)22-18(24)11-10-16-19(13-4-2-3-5-13)23-17(20)12-21-16/h6-9,12-13H,2-5,10-11H2,1H3,(H,22,24)