[4-(3-methylsulfonylphenoxy)phenyl]-[(2S)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methanone

Systemtic Name: [4-(3-methylsulfonylphenoxy)phenyl]-[(2S)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methanone Openeye Name: [4-(3-methylsulfonylphenoxy)phenyl]-[(2S)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methanone CAS Name: [4-(3-methylsulfonylphenoxy)phenyl]-[(2S)-2-(1-pyrrolidinylmethyl)-1-pyrrolidinyl]methanone IUPAC Name: [4-(3-methylsulfonylphenoxy)phenyl]-[(2S)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methanone Traditional Name: [4-(3-mesylphenoxy)phenyl]-[(2S)-2-(pyrrolidinomethyl)pyrrolidino]methanone Formula: C23H28N2O4S MolecularWeight: 428.54442

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)OC2=CC=C(C=C2)C(=O)N3CCCC3CN4CCCC4

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)OC2=CC=C(C=C2)C(=O)N3CCC[C@H]3CN4CCCC4

InChI

InChI=1S/C23H28N2O4S/c1-30(27,28)22-8-4-7-21(16-22)29-20-11-9-18(10-12-20)23(26)25-15-5-6-19(25)17-24-13-2-3-14-24/h4,7-12,16,19H,2-3,5-6,13-15,17H2,1H3/t19-/m0/s1