(4S)-4-(4-cyano-2-methylsulfonyl-phenyl)-6-methyl-2-oxidanylidene-3-propan-2-ylsulfonyl-1-[3-(trifluoromethyl)phenyl]-4H-pyrimidine-5-carbonitrile

Systemtic Name: (4S)-4-(4-cyano-2-methylsulfonyl-phenyl)-6-methyl-2-oxidanylidene-3-propan-2-ylsulfonyl-1-[3-(trifluoromethyl)phenyl]-4H-pyrimidine-5-carbonitrile Openeye Name: (4S)-4-(4-cyano-2-methylsulfonyl-phenyl)-3-isopropylsulfonyl-6-methyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-4H-pyrimidine-5-carbonitrile CAS Name: (4S)-4-(4-cyano-2-methylsulfonylphenyl)-6-methyl-2-oxo-3-propan-2-ylsulfonyl-1-[3-(trifluoromethyl)phenyl]-4H-pyrimidine-5-carbonitrile IUPAC Name: (4S)-4-(4-cyano-2-methylsulfonylphenyl)-6-methyl-2-oxo-3-propan-2-ylsulfonyl-1-[3-(trifluoromethyl)phenyl]-4H-pyrimidine-5-carbonitrile Traditional Name: (4S)-4-(4-cyano-2-mesyl-phenyl)-3-isopropylsulfonyl-2-keto-6-methyl-1-[3-(trifluoromethyl)phenyl]-4H-pyrimidine-5-carbonitrile Formula: C24H21F3N4O5S2 MolecularWeight: 566.57255

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)S(=O)(=O)C(C)C)C3=C(C=C(C=C3)C#N)S(=O)(=O)C)C#N

Isomeric SMILES

CC1=C([C@H](N(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)S(=O)(=O)C(C)C)C3=C(C=C(C=C3)C#N)S(=O)(=O)C)C#N

InChI

InChI=1S/C24H21F3N4O5S2/c1-14(2)38(35,36)31-22(19-9-8-16(12-28)10-21(19)37(4,33)34)20(13-29)15(3)30(23(31)32)18-7-5-6-17(11-18)24(25,26)27/h5-11,14,22H,1-4H3/t22-/m1/s1