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1-[(3R)-2-ethanoyl-5-methylsulfinyl-3-phenyl-3H-1,2,4-triazol-4-yl]ethanone

1-[(3R)-2-ethanoyl-5-methylsulfinyl-3-phenyl-3H-1,2,4-triazol-4-yl]ethanone

Systemtic Name:1-[(3R)-2-ethanoyl-5-methylsulfinyl-3-phenyl-3H-1,2,4-triazol-4-yl]ethanone
Openeye Name:1-[(3R)-2-acetyl-5-methylsulfinyl-3-phenyl-3H-1,2,4-triazol-4-yl]ethanone
CAS Name:1-[(3R)-2-acetyl-5-methylsulfinyl-3-phenyl-3H-1,2,4-triazol-4-yl]ethanone
IUPAC Name:1-[(3R)-2-acetyl-5-methylsulfinyl-3-phenyl-3H-1,2,4-triazol-4-yl]ethanone
Traditional Name:1-[(3R)-2-acetyl-5-methylsulfinyl-3-phenyl-3H-1,2,4-triazol-4-yl]ethanone
Formula: C13H15N3O3S
MolecularWeight: 293.3415
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(N(N=C1S(=O)C)C(=O)C)C2=CC=CC=C2


Isomeric SMILES

CC(=O)N1[C@H](N(N=C1S(=O)C)C(=O)C)C2=CC=CC=C2


InChI

InChI=1S/C13H15N3O3S/c1-9(17)15-12(11-7-5-4-6-8-11)16(10(2)18)14-13(15)20(3)19/h4-8,12H,1-3H3/t12-,20?/m1/s1


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