2-[4-methylsulfonyl-3-(trifluoromethyl)phenyl]-3-(oxan-3-yl)-N-pyrazin-2-yl-propanamide

Systemtic Name: 2-[4-methylsulfonyl-3-(trifluoromethyl)phenyl]-3-(oxan-3-yl)-N-pyrazin-2-yl-propanamide Openeye Name: 2-[4-methylsulfonyl-3-(trifluoromethyl)phenyl]-N-pyrazin-2-yl-3-tetrahydropyran-3-yl-propanamide CAS Name: 2-[4-methylsulfonyl-3-(trifluoromethyl)phenyl]-3-(3-oxanyl)-N-(2-pyrazinyl)propanamide IUPAC Name: 2-[4-methylsulfonyl-3-(trifluoromethyl)phenyl]-3-(oxan-3-yl)-N-pyrazin-2-ylpropanamide Traditional Name: 2-[4-mesyl-3-(trifluoromethyl)phenyl]-N-pyrazin-2-yl-3-tetrahydropyran-3-yl-propionamide Formula: C20H22F3N3O4S MolecularWeight: 457.46659

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C=C1)C(CC2CCCOC2)C(=O)NC3=NC=CN=C3)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C=C1)C(CC2CCCOC2)C(=O)NC3=NC=CN=C3)C(F)(F)F

InChI

InChI=1S/C20H22F3N3O4S/c1-31(28,29)17-5-4-14(10-16(17)20(21,22)23)15(9-13-3-2-8-30-12-13)19(27)26-18-11-24-6-7-25-18/h4-7,10-11,13,15H,2-3,8-9,12H2,1H3,(H,25,26,27)