2-[4-(3-propan-2-ylsulfonylphenyl)piperazin-1-yl]-6-[5-(trifluoromethyl)-1H-pyrazol-4-yl]quinoline

Systemtic Name: 2-[4-(3-propan-2-ylsulfonylphenyl)piperazin-1-yl]-6-[5-(trifluoromethyl)-1H-pyrazol-4-yl]quinoline Openeye Name: 2-[4-(3-isopropylsulfonylphenyl)piperazin-1-yl]-6-[5-(trifluoromethyl)-1H-pyrazol-4-yl]quinoline CAS Name: 2-[4-(3-propan-2-ylsulfonylphenyl)-1-piperazinyl]-6-[5-(trifluoromethyl)-1H-pyrazol-4-yl]quinoline IUPAC Name: 2-[4-(3-propan-2-ylsulfonylphenyl)piperazin-1-yl]-6-[5-(trifluoromethyl)-1H-pyrazol-4-yl]quinoline Traditional Name: 2-[4-(3-isopropylsulfonylphenyl)piperazino]-6-[5-(trifluoromethyl)-1H-pyrazol-4-yl]quinoline Formula: C26H26F3N5O2S MolecularWeight: 529.57715

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CC=CC(=C1)N2CCN(CC2)C3=NC4=C(C=C3)C=C(C=C4)C5=C(NN=C5)C(F)(F)F

Isomeric SMILES

CC(C)S(=O)(=O)C1=CC=CC(=C1)N2CCN(CC2)C3=NC4=C(C=C3)C=C(C=C4)C5=C(NN=C5)C(F)(F)F

InChI

InChI=1S/C26H26F3N5O2S/c1-17(2)37(35,36)21-5-3-4-20(15-21)33-10-12-34(13-11-33)24-9-7-19-14-18(6-8-23(19)31-24)22-16-30-32-25(22)26(27,28)29/h3-9,14-17H,10-13H2,1-2H3,(H,30,32)