(2R)-2-(3-chloranyl-4-methylsulfonyl-phenyl)-3-cyclopentyl-N-[5-(4-oxidanylbut-1-ynyl)pyrazin-2-yl]propanamide

Systemtic Name: (2R)-2-(3-chloranyl-4-methylsulfonyl-phenyl)-3-cyclopentyl-N-[5-(4-oxidanylbut-1-ynyl)pyrazin-2-yl]propanamide Openeye Name: (2R)-2-(3-chloro-4-methylsulfonyl-phenyl)-3-cyclopentyl-N-[5-(4-hydroxybut-1-ynyl)pyrazin-2-yl]propanamide CAS Name: (2R)-2-(3-chloro-4-methylsulfonylphenyl)-3-cyclopentyl-N-[5-(4-hydroxybut-1-ynyl)-2-pyrazinyl]propanamide IUPAC Name: (2R)-2-(3-chloro-4-methylsulfonylphenyl)-3-cyclopentyl-N-[5-(4-hydroxybut-1-ynyl)pyrazin-2-yl]propanamide Traditional Name: (2R)-2-(3-chloro-4-mesyl-phenyl)-3-cyclopentyl-N-[5-(4-hydroxybut-1-ynyl)pyrazin-2-yl]propionamide Formula: C23H26ClN3O4S MolecularWeight: 475.98824

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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(N=C3)C#CCCO)Cl

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C=C1)[C@@H](CC2CCCC2)C(=O)NC3=NC=C(N=C3)C#CCCO)Cl

InChI

InChI=1S/C23H26ClN3O4S/c1-32(30,31)21-10-9-17(13-20(21)24)19(12-16-6-2-3-7-16)23(29)27-22-15-25-18(14-26-22)8-4-5-11-28/h9-10,13-16,19,28H,2-3,5-7,11-12H2,1H3,(H,26,27,29)/t19-/m1/s1