2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-4-(trifluoromethyl)pyrimidine

Systemtic Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-4-(trifluoromethyl)pyrimidine Openeye Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-4-(trifluoromethyl)pyrimidine CAS Name: 2-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-4-(trifluoromethyl)pyrimidine IUPAC Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-4-(trifluoromethyl)pyrimidine Traditional Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazino]-4-(trifluoromethyl)pyrimidine Formula: C17H19F3N4O2S MolecularWeight: 400.41857

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=CC(=N3)C(F)(F)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=CC(=N3)C(F)(F)F)C

InChI

InChI=1S/C17H19F3N4O2S/c1-12-3-4-14(11-13(12)2)27(25,26)24-9-7-23(8-10-24)16-21-6-5-15(22-16)17(18,19)20/h3-6,11H,7-10H2,1-2H3