5-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]sulfonyl-1,3-dimethyl-pyrimidine-2,4-dione

Systemtic Name: 5-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]sulfonyl-1,3-dimethyl-pyrimidine-2,4-dione Openeye Name: 5-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]sulfonyl-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 5-[[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyrrolidinyl]sulfonyl]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 5-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]sulfonyl-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 5-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidino]sulfonyl-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C18H21N3O6S MolecularWeight: 407.44084

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)N(C1=O)C)S(=O)(=O)N2CCCC2C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CN1C=C(C(=O)N(C1=O)C)S(=O)(=O)N2CCC[C@H]2C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C18H21N3O6S/c1-19-11-16(17(22)20(2)18(19)23)28(24,25)21-7-3-4-13(21)12-5-6-14-15(10-12)27-9-8-26-14/h5-6,10-11,13H,3-4,7-9H2,1-2H3/t13-/m0/s1