4-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-6-chloranyl-2-methylsulfanyl-pyrimidine

Systemtic Name: 4-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-6-chloranyl-2-methylsulfanyl-pyrimidine Openeye Name: 4-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-6-chloro-2-methylsulfanyl-pyrimidine CAS Name: 4-[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-6-chloro-2-(methylthio)pyrimidine IUPAC Name: 4-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-6-chloro-2-methylsulfanylpyrimidine Traditional Name: 4-[4-[bis(4-fluorophenyl)methyl]piperazino]-6-chloro-2-(methylthio)pyrimidine Formula: C22H21ClF2N4S MolecularWeight: 446.943746

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=CC(=N1)Cl)N2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

CSC1=NC(=CC(=N1)Cl)N2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H21ClF2N4S/c1-30-22-26-19(23)14-20(27-22)28-10-12-29(13-11-28)21(15-2-6-17(24)7-3-15)16-4-8-18(25)9-5-16/h2-9,14,21H,10-13H2,1H3