2-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethylsulfonyl]-1,3-benzoxazole

Systemtic Name: 2-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethylsulfonyl]-1,3-benzoxazole Openeye Name: 2-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethylsulfonyl]-1,3-benzoxazole CAS Name: 2-[2-[(4,6-dimethyl-2-pyrimidinyl)thio]ethylsulfonyl]-1,3-benzoxazole IUPAC Name: 2-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethylsulfonyl]-1,3-benzoxazole Traditional Name: 2-[2-[(4,6-dimethylpyrimidin-2-yl)thio]ethylsulfonyl]-1,3-benzoxazole Formula: C15H15N3O3S2 MolecularWeight: 349.4279

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCCS(=O)(=O)C2=NC3=CC=CC=C3O2)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCCS(=O)(=O)C2=NC3=CC=CC=C3O2)C

InChI

InChI=1S/C15H15N3O3S2/c1-10-9-11(2)17-14(16-10)22-7-8-23(19,20)15-18-12-5-3-4-6-13(12)21-15/h3-6,9H,7-8H2,1-2H3