4-[4-(4-fluorophenyl)piperazin-1-yl]-2-methylsulfanyl-6-phenyl-pyrimidine

Systemtic Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-2-methylsulfanyl-6-phenyl-pyrimidine Openeye Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-2-methylsulfanyl-6-phenyl-pyrimidine CAS Name: 4-[4-(4-fluorophenyl)-1-piperazinyl]-2-(methylthio)-6-phenylpyrimidine IUPAC Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-2-methylsulfanyl-6-phenylpyrimidine Traditional Name: 4-[4-(4-fluorophenyl)piperazino]-2-(methylthio)-6-phenyl-pyrimidine Formula: C21H21FN4S MolecularWeight: 380.481643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21FN4S/c1-27-21-23-19(16-5-3-2-4-6-16)15-20(24-21)26-13-11-25(12-14-26)18-9-7-17(22)8-10-18/h2-10,15H,11-14H2,1H3