(2R)-2-(3-chloranyl-4-methylsulfonyl-phenyl)-3-cyclopentyl-N-[5-(methylsulfinylmethyl)pyrazin-2-yl]propanamide

Systemtic Name: (2R)-2-(3-chloranyl-4-methylsulfonyl-phenyl)-3-cyclopentyl-N-[5-(methylsulfinylmethyl)pyrazin-2-yl]propanamide Openeye Name: (2R)-2-(3-chloro-4-methylsulfonyl-phenyl)-3-cyclopentyl-N-[5-(methylsulfinylmethyl)pyrazin-2-yl]propanamide CAS Name: (2R)-2-(3-chloro-4-methylsulfonylphenyl)-3-cyclopentyl-N-[5-(methylsulfinylmethyl)-2-pyrazinyl]propanamide IUPAC Name: (2R)-2-(3-chloro-4-methylsulfonylphenyl)-3-cyclopentyl-N-[5-(methylsulfinylmethyl)pyrazin-2-yl]propanamide Traditional Name: (2R)-2-(3-chloro-4-mesyl-phenyl)-3-cyclopentyl-N-[5-(methylsulfinylmethyl)pyrazin-2-yl]propionamide Formula: C21H26ClN3O4S2 MolecularWeight: 484.03184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)CC1=CN=C(C=N1)NC(=O)C(CC2CCCC2)C3=CC(=C(C=C3)S(=O)(=O)C)Cl

Isomeric SMILES

CS(=O)CC1=CN=C(C=N1)NC(=O)[C@H](CC2CCCC2)C3=CC(=C(C=C3)S(=O)(=O)C)Cl

InChI

InChI=1S/C21H26ClN3O4S2/c1-30(27)13-16-11-24-20(12-23-16)25-21(26)17(9-14-5-3-4-6-14)15-7-8-19(18(22)10-15)31(2,28)29/h7-8,10-12,14,17H,3-6,9,13H2,1-2H3,(H,24,25,26)/t17-,30?/m1/s1