4-chloranyl-2-methylsulfanyl-6-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pyrimidine

Systemtic Name: 4-chloranyl-2-methylsulfanyl-6-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pyrimidine Openeye Name: 4-chloro-2-methylsulfanyl-6-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pyrimidine CAS Name: 4-chloro-2-(methylthio)-6-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]pyrimidine IUPAC Name: 4-chloro-2-methylsulfanyl-6-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pyrimidine Traditional Name: 4-chloro-2-(methylthio)-6-[4-[3-(trifluoromethyl)phenyl]piperazino]pyrimidine Formula: C16H16ClF3N4S MolecularWeight: 388.83825

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16ClF3N4S/c1-25-15-21-13(17)10-14(22-15)24-7-5-23(6-8-24)12-4-2-3-11(9-12)16(18,19)20/h2-4,9-10H,5-8H2,1H3