(3S)-3-[4-(4-chlorophenyl)-6-methyl-pyrimidin-2-yl]sulfanylthiolane 1,1-dioxide

Systemtic Name: (3S)-3-[4-(4-chlorophenyl)-6-methyl-pyrimidin-2-yl]sulfanylthiolane 1,1-dioxide Openeye Name: (3S)-3-[4-(4-chlorophenyl)-6-methyl-pyrimidin-2-yl]sulfanylthiolane 1,1-dioxide CAS Name: (3S)-3-[[4-(4-chlorophenyl)-6-methyl-2-pyrimidinyl]thio]thiolane 1,1-dioxide IUPAC Name: (3S)-3-[4-(4-chlorophenyl)-6-methylpyrimidin-2-yl]sulfanylthiolane 1,1-dioxide Traditional Name: (3S)-3-[[4-(4-chlorophenyl)-6-methyl-pyrimidin-2-yl]thio]sulfolane Formula: C15H15ClN2O2S2 MolecularWeight: 354.8748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=C(C=C2)Cl)SC3CCS(=O)(=O)C3

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=C(C=C2)Cl)S[C@H]3CCS(=O)(=O)C3

InChI

InChI=1S/C15H15ClN2O2S2/c1-10-8-14(11-2-4-12(16)5-3-11)18-15(17-10)21-13-6-7-22(19,20)9-13/h2-5,8,13H,6-7,9H2,1H3/t13-/m0/s1