5-[(3-chloranyl-4-methylsulfonyl-phenyl)-(3-cyclopentylpropanoyl)amino]pyrazine-2-sulfonyl chloride

Systemtic Name: 5-[(3-chloranyl-4-methylsulfonyl-phenyl)-(3-cyclopentylpropanoyl)amino]pyrazine-2-sulfonyl chloride Openeye Name: 5-[3-chloro-N-(3-cyclopentylpropanoyl)-4-methylsulfonyl-anilino]pyrazine-2-sulfonyl chloride CAS Name: 5-(3-chloro-N-(3-cyclopentyl-1-oxopropyl)-4-methylsulfonylanilino)-2-pyrazinesulfonyl chloride IUPAC Name: 5-[3-chloro-N-(3-cyclopentylpropanoyl)-4-methylsulfonylanilino]pyrazine-2-sulfonyl chloride Traditional Name: 5-[3-chloro-N-(3-cyclopentylpropanoyl)-4-mesyl-anilino]pyrazine-2-sulfonyl chloride Formula: C19H21Cl2N3O5S2 MolecularWeight: 506.42314

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C=C1)N(C2=CN=C(C=N2)S(=O)(=O)Cl)C(=O)CCC3CCCC3)Cl

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C=C1)N(C2=CN=C(C=N2)S(=O)(=O)Cl)C(=O)CCC3CCCC3)Cl

InChI

InChI=1S/C19H21Cl2N3O5S2/c1-30(26,27)16-8-7-14(10-15(16)20)24(19(25)9-6-13-4-2-3-5-13)17-11-23-18(12-22-17)31(21,28)29/h7-8,10-13H,2-6,9H2,1H3