2-[(2S,5S)-1-ethyl-5-phenyl-pyrrolidin-2-yl]-5-(5-ethylsulfonyl-2-methoxy-phenyl)-1H-pyrrole

Systemtic Name: 2-[(2S,5S)-1-ethyl-5-phenyl-pyrrolidin-2-yl]-5-(5-ethylsulfonyl-2-methoxy-phenyl)-1H-pyrrole Openeye Name: 2-[(2S,5S)-1-ethyl-5-phenyl-pyrrolidin-2-yl]-5-(5-ethylsulfonyl-2-methoxy-phenyl)-1H-pyrrole CAS Name: 2-[(2S,5S)-1-ethyl-5-phenyl-2-pyrrolidinyl]-5-(5-ethylsulfonyl-2-methoxyphenyl)-1H-pyrrole IUPAC Name: 2-[(2S,5S)-1-ethyl-5-phenylpyrrolidin-2-yl]-5-(5-ethylsulfonyl-2-methoxyphenyl)-1H-pyrrole Traditional Name: 2-(5-esyl-2-methoxy-phenyl)-5-[(2S,5S)-1-ethyl-5-phenyl-pyrrolidin-2-yl]-1H-pyrrole Formula: C25H30N2O3S MolecularWeight: 438.5823

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(CCC1C2=CC=C(N2)C3=C(C=CC(=C3)S(=O)(=O)CC)OC)C4=CC=CC=C4

Isomeric SMILES

CCN1[C@@H](CC[C@H]1C2=CC=C(N2)C3=C(C=CC(=C3)S(=O)(=O)CC)OC)C4=CC=CC=C4

InChI

InChI=1S/C25H30N2O3S/c1-4-27-23(18-9-7-6-8-10-18)14-15-24(27)22-13-12-21(26-22)20-17-19(31(28,29)5-2)11-16-25(20)30-3/h6-13,16-17,23-24,26H,4-5,14-15H2,1-3H3/t23-,24-/m0/s1