(3S)-3-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]thiolane 1,1-dioxide

Systemtic Name: (3S)-3-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]thiolane 1,1-dioxide Openeye Name: (3S)-3-[[4-phenyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]thiolane 1,1-dioxide CAS Name: (3S)-3-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]thiolane 1,1-dioxide IUPAC Name: (3S)-3-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]thiolane 1,1-dioxide Traditional Name: (3S)-3-[[4-phenyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]sulfolane Formula: C17H16N4O2S2 MolecularWeight: 372.46454

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1SC2=NN=C(N2C3=CC=CC=C3)C4=CC=NC=C4

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1SC2=NN=C(N2C3=CC=CC=C3)C4=CC=NC=C4

InChI

InChI=1S/C17H16N4O2S2/c22-25(23)11-8-15(12-25)24-17-20-19-16(13-6-9-18-10-7-13)21(17)14-4-2-1-3-5-14/h1-7,9-10,15H,8,11-12H2/t15-/m0/s1