1-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-3-(2-methoxyphenyl)sulfanyl-propan-2-ol

Systemtic Name: 1-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-3-(2-methoxyphenyl)sulfanyl-propan-2-ol Openeye Name: 1-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-3-(2-methoxyphenyl)sulfanyl-propan-2-ol CAS Name: 1-[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-3-[(2-methoxyphenyl)thio]-2-propanol IUPAC Name: 1-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-3-(2-methoxyphenyl)sulfanylpropan-2-ol Traditional Name: 1-[4-[bis(4-fluorophenyl)methyl]piperazino]-3-[(2-methoxyphenyl)thio]propan-2-ol Formula: C27H30F2N2O2S MolecularWeight: 484.601106

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1SCC(CN2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F)O

Isomeric SMILES

COC1=CC=CC=C1SCC(CN2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F)O

InChI

InChI=1S/C27H30F2N2O2S/c1-33-25-4-2-3-5-26(25)34-19-24(32)18-30-14-16-31(17-15-30)27(20-6-10-22(28)11-7-20)21-8-12-23(29)13-9-21/h2-13,24,27,32H,14-19H2,1H3