N-[4-[(2R)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylpropanoyl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[(2R)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylpropanoyl]phenyl]methanesulfonamide Openeye Name: N-[4-[(2R)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylpropanoyl]phenyl]methanesulfonamide CAS Name: N-[4-[(2R)-1-oxo-2-[(4,5,6-trimethyl-2-pyrimidinyl)thio]propyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[(2R)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylpropanoyl]phenyl]methanesulfonamide Traditional Name: N-[4-[(2R)-2-[(4,5,6-trimethylpyrimidin-2-yl)thio]propanoyl]phenyl]methanesulfonamide Formula: C17H21N3O3S2 MolecularWeight: 379.49694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1C)SC(C)C(=O)C2=CC=C(C=C2)NS(=O)(=O)C)C

Isomeric SMILES

CC1=C(N=C(N=C1C)S[C@H](C)C(=O)C2=CC=C(C=C2)NS(=O)(=O)C)C

InChI

InChI=1S/C17H21N3O3S2/c1-10-11(2)18-17(19-12(10)3)24-13(4)16(21)14-6-8-15(9-7-14)20-25(5,22)23/h6-9,13,20H,1-5H3/t13-/m1/s1