3-(4-pyrrolidin-1-ylsulfonylphenyl)-1-(2-thiophen-2-ylpyrrolidin-1-yl)propan-1-one

Systemtic Name: 3-(4-pyrrolidin-1-ylsulfonylphenyl)-1-(2-thiophen-2-ylpyrrolidin-1-yl)propan-1-one Openeye Name: 3-(4-pyrrolidin-1-ylsulfonylphenyl)-1-[2-(2-thienyl)pyrrolidin-1-yl]propan-1-one CAS Name: 3-[4-(1-pyrrolidinylsulfonyl)phenyl]-1-(2-thiophen-2-yl-1-pyrrolidinyl)-1-propanone IUPAC Name: 3-(4-pyrrolidin-1-ylsulfonylphenyl)-1-(2-thiophen-2-ylpyrrolidin-1-yl)propan-1-one Traditional Name: 3-(4-pyrrolidinosulfonylphenyl)-1-[2-(2-thienyl)pyrrolidino]propan-1-one Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)N3CCCC3C4=CC=CS4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)N3CCCC3C4=CC=CS4

InChI

InChI=1S/C21H26N2O3S2/c24-21(23-15-3-5-19(23)20-6-4-16-27-20)12-9-17-7-10-18(11-8-17)28(25,26)22-13-1-2-14-22/h4,6-8,10-11,16,19H,1-3,5,9,12-15H2