1-[4-(diphenylmethyl)piperazin-1-yl]-2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propan-1-one

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-1-yl]-2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propan-1-one Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propan-1-one CAS Name: 1-[4-(diphenylmethyl)-1-piperazinyl]-2-[[4-phenyl-6-(trifluoromethyl)-2-pyrimidinyl]thio]-1-propanone IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropan-1-one Traditional Name: 1-(4-benzhydrylpiperazino)-2-[[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]thio]propan-1-one Formula: C31H29F3N4OS MolecularWeight: 562.64837

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)SC4=NC(=CC(=N4)C(F)(F)F)C5=CC=CC=C5

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)SC4=NC(=CC(=N4)C(F)(F)F)C5=CC=CC=C5

InChI

InChI=1S/C31H29F3N4OS/c1-22(40-30-35-26(23-11-5-2-6-12-23)21-27(36-30)31(32,33)34)29(39)38-19-17-37(18-20-38)28(24-13-7-3-8-14-24)25-15-9-4-10-16-25/h2-16,21-22,28H,17-20H2,1H3