1-[4-[4-(2-propan-2-ylphenyl)sulfanyl-3-(trifluoromethyl)phenyl]pyridin-2-yl]-4-pyridin-2-yl-piperazine

Systemtic Name: 1-[4-[4-(2-propan-2-ylphenyl)sulfanyl-3-(trifluoromethyl)phenyl]pyridin-2-yl]-4-pyridin-2-yl-piperazine Openeye Name: 1-[4-[4-(2-isopropylphenyl)sulfanyl-3-(trifluoromethyl)phenyl]-2-pyridyl]-4-(2-pyridyl)piperazine CAS Name: 1-[4-[4-[(2-propan-2-ylphenyl)thio]-3-(trifluoromethyl)phenyl]-2-pyridinyl]-4-(2-pyridinyl)piperazine IUPAC Name: 1-[4-[4-(2-propan-2-ylphenyl)sulfanyl-3-(trifluoromethyl)phenyl]pyridin-2-yl]-4-pyridin-2-ylpiperazine Traditional Name: 1-[4-[4-(o-cumenylthio)-3-(trifluoromethyl)phenyl]-2-pyridyl]-4-(2-pyridyl)piperazine Formula: C30H29F3N4S MolecularWeight: 534.63827

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1SC2=C(C=C(C=C2)C3=CC(=NC=C3)N4CCN(CC4)C5=CC=CC=N5)C(F)(F)F

Isomeric SMILES

CC(C)C1=CC=CC=C1SC2=C(C=C(C=C2)C3=CC(=NC=C3)N4CCN(CC4)C5=CC=CC=N5)C(F)(F)F

InChI

InChI=1S/C30H29F3N4S/c1-21(2)24-7-3-4-8-26(24)38-27-11-10-22(19-25(27)30(31,32)33)23-12-14-35-29(20-23)37-17-15-36(16-18-37)28-9-5-6-13-34-28/h3-14,19-21H,15-18H2,1-2H3