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

Systemtic Name: (3S)-3-[4-(4-methoxyphenyl)-6-methyl-pyrimidin-2-yl]sulfanylthiolane 1,1-dioxide Openeye Name: (3S)-3-[4-(4-methoxyphenyl)-6-methyl-pyrimidin-2-yl]sulfanylthiolane 1,1-dioxide CAS Name: (3S)-3-[[4-(4-methoxyphenyl)-6-methyl-2-pyrimidinyl]thio]thiolane 1,1-dioxide IUPAC Name: (3S)-3-[4-(4-methoxyphenyl)-6-methylpyrimidin-2-yl]sulfanylthiolane 1,1-dioxide Traditional Name: (3S)-3-[[4-(4-methoxyphenyl)-6-methyl-pyrimidin-2-yl]thio]sulfolane Formula: C16H18N2O3S2 MolecularWeight: 350.45572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O3S2/c1-11-9-15(12-3-5-13(21-2)6-4-12)18-16(17-11)22-14-7-8-23(19,20)10-14/h3-6,9,14H,7-8,10H2,1-2H3/t14-/m0/s1