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

Systemtic Name: 1-ethyl-4-[4-[4-(2-propan-2-ylphenyl)sulfanyl-3-(trifluoromethyl)phenyl]pyridin-2-yl]piperazine Openeye Name: 1-ethyl-4-[4-[4-(2-isopropylphenyl)sulfanyl-3-(trifluoromethyl)phenyl]-2-pyridyl]piperazine CAS Name: 1-ethyl-4-[4-[4-[(2-propan-2-ylphenyl)thio]-3-(trifluoromethyl)phenyl]-2-pyridinyl]piperazine IUPAC Name: 1-ethyl-4-[4-[4-(2-propan-2-ylphenyl)sulfanyl-3-(trifluoromethyl)phenyl]pyridin-2-yl]piperazine Traditional Name: 1-ethyl-4-[4-[4-(o-cumenylthio)-3-(trifluoromethyl)phenyl]-2-pyridyl]piperazine Formula: C27H30F3N3S MolecularWeight: 485.60741

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC=CC(=C2)C3=CC(=C(C=C3)SC4=CC=CC=C4C(C)C)C(F)(F)F

Isomeric SMILES

CCN1CCN(CC1)C2=NC=CC(=C2)C3=CC(=C(C=C3)SC4=CC=CC=C4C(C)C)C(F)(F)F

InChI

InChI=1S/C27H30F3N3S/c1-4-32-13-15-33(16-14-32)26-18-21(11-12-31-26)20-9-10-25(23(17-20)27(28,29)30)34-24-8-6-5-7-22(24)19(2)3/h5-12,17-19H,4,13-16H2,1-3H3