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

Systemtic Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-6-[(4-methoxyphenyl)methylsulfanyl]pyrimidine Openeye Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-6-[(4-methoxyphenyl)methylsulfanyl]pyrimidine CAS Name: 4-[4-(4-fluorophenyl)-1-piperazinyl]-6-[(4-methoxyphenyl)methylthio]pyrimidine IUPAC Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-6-[(4-methoxyphenyl)methylsulfanyl]pyrimidine Traditional Name: 4-[4-(4-fluorophenyl)piperazino]-6-(p-anisylthio)pyrimidine Formula: C22H23FN4OS MolecularWeight: 410.507623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC2=NC=NC(=C2)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=C(C=C1)CSC2=NC=NC(=C2)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H23FN4OS/c1-28-20-8-2-17(3-9-20)15-29-22-14-21(24-16-25-22)27-12-10-26(11-13-27)19-6-4-18(23)5-7-19/h2-9,14,16H,10-13,15H2,1H3