1-[(2S)-2-(3-phenylpropylsulfonylmethyl)pyrrolidin-1-yl]-2-pyridin-3-yl-ethane-1,2-dione

Systemtic Name: 1-[(2S)-2-(3-phenylpropylsulfonylmethyl)pyrrolidin-1-yl]-2-pyridin-3-yl-ethane-1,2-dione Openeye Name: 1-[(2S)-2-(3-phenylpropylsulfonylmethyl)pyrrolidin-1-yl]-2-(3-pyridyl)ethane-1,2-dione CAS Name: 1-[(2S)-2-(3-phenylpropylsulfonylmethyl)-1-pyrrolidinyl]-2-(3-pyridinyl)ethane-1,2-dione IUPAC Name: 1-[(2S)-2-(3-phenylpropylsulfonylmethyl)pyrrolidin-1-yl]-2-pyridin-3-ylethane-1,2-dione Traditional Name: 1-[(2S)-2-(3-phenylpropylsulfonylmethyl)pyrrolidino]-2-(3-pyridyl)ethane-1,2-dione Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(=O)C2=CN=CC=C2)CS(=O)(=O)CCCC3=CC=CC=C3

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C(=O)C2=CN=CC=C2)CS(=O)(=O)CCCC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O4S/c24-20(18-10-4-12-22-15-18)21(25)23-13-5-11-19(23)16-28(26,27)14-6-9-17-7-2-1-3-8-17/h1-4,7-8,10,12,15,19H,5-6,9,11,13-14,16H2/t19-/m0/s1