5-[[(2R)-2-(3-chloranyl-4-methylsulfonyl-phenyl)-3-cyclopentyl-propanoyl]amino]-N-oxidanylidene-1,4-dihydropyrazine-2-carboxamide

Systemtic Name: 5-[[(2R)-2-(3-chloranyl-4-methylsulfonyl-phenyl)-3-cyclopentyl-propanoyl]amino]-N-oxidanylidene-1,4-dihydropyrazine-2-carboxamide Openeye Name: 5-[[(2R)-2-(3-chloro-4-methylsulfonyl-phenyl)-3-cyclopentyl-propanoyl]amino]-N-oxo-1,4-dihydropyrazine-2-carboxamide CAS Name: 5-[[(2R)-2-(3-chloro-4-methylsulfonylphenyl)-3-cyclopentyl-1-oxopropyl]amino]-N-oxo-1,4-dihydropyrazine-2-carboxamide IUPAC Name: 5-[[(2R)-2-(3-chloro-4-methylsulfonylphenyl)-3-cyclopentylpropanoyl]amino]-N-oxo-1,4-dihydropyrazine-2-carboxamide Traditional Name: 5-[[(2R)-2-(3-chloro-4-mesyl-phenyl)-3-cyclopentyl-propanoyl]amino]-N-keto-1,4-dihydropyrazine-2-carboxamide Formula: C20H23ClN4O5S MolecularWeight: 466.93842

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C=C1)C(CC2CCCC2)C(=O)NC3=CNC(=CN3)C(=O)N=O)Cl

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C=C1)[C@@H](CC2CCCC2)C(=O)NC3=CNC(=CN3)C(=O)N=O)Cl

InChI

InChI=1S/C20H23ClN4O5S/c1-31(29,30)17-7-6-13(9-15(17)21)14(8-12-4-2-3-5-12)19(26)24-18-11-22-16(10-23-18)20(27)25-28/h6-7,9-12,14,22-23H,2-5,8H2,1H3,(H,24,26)/t14-/m1/s1