[4-(3-methylsulfonylpyrrolidin-1-yl)sulfonylphenyl]-[(2S)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methanone

Systemtic Name: [4-(3-methylsulfonylpyrrolidin-1-yl)sulfonylphenyl]-[(2S)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methanone Openeye Name: [4-(3-methylsulfonylpyrrolidin-1-yl)sulfonylphenyl]-[(2S)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methanone CAS Name: [4-[(3-methylsulfonyl-1-pyrrolidinyl)sulfonyl]phenyl]-[(2S)-2-(1-pyrrolidinylmethyl)-1-pyrrolidinyl]methanone IUPAC Name: [4-(3-methylsulfonylpyrrolidin-1-yl)sulfonylphenyl]-[(2S)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methanone Traditional Name: [4-(3-mesylpyrrolidino)sulfonylphenyl]-[(2S)-2-(pyrrolidinomethyl)pyrrolidino]methanone Formula: C21H31N3O5S2 MolecularWeight: 469.61794

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCCC3CN4CCCC4

Isomeric SMILES

CS(=O)(=O)C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCC[C@H]3CN4CCCC4

InChI

InChI=1S/C21H31N3O5S2/c1-30(26,27)20-10-14-23(16-20)31(28,29)19-8-6-17(7-9-19)21(25)24-13-4-5-18(24)15-22-11-2-3-12-22/h6-9,18,20H,2-5,10-16H2,1H3/t18-,20?/m0/s1