5-[(2S)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonyl-1,3-dimethyl-pyrimidine-2,4-dione

Systemtic Name: 5-[(2S)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonyl-1,3-dimethyl-pyrimidine-2,4-dione Openeye Name: 5-[[(2S)-2-(1,3-benzothiazol-2-yl)-1-piperidyl]sulfonyl]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 5-[[(2S)-2-(1,3-benzothiazol-2-yl)-1-piperidinyl]sulfonyl]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 5-[(2S)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonyl-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 5-[(2S)-2-(1,3-benzothiazol-2-yl)piperidino]sulfonyl-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C18H20N4O4S2 MolecularWeight: 420.5058

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)N(C1=O)C)S(=O)(=O)N2CCCCC2C3=NC4=CC=CC=C4S3

Isomeric SMILES

CN1C=C(C(=O)N(C1=O)C)S(=O)(=O)N2CCCC[C@H]2C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H20N4O4S2/c1-20-11-15(17(23)21(2)18(20)24)28(25,26)22-10-6-5-8-13(22)16-19-12-7-3-4-9-14(12)27-16/h3-4,7,9,11,13H,5-6,8,10H2,1-2H3/t13-/m0/s1