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

Systemtic Name: 4-[4-(2-fluorophenyl)piperazin-1-yl]-6-[(4-methoxyphenyl)methylsulfanyl]pyrimidine Openeye Name: 4-[4-(2-fluorophenyl)piperazin-1-yl]-6-[(4-methoxyphenyl)methylsulfanyl]pyrimidine CAS Name: 4-[4-(2-fluorophenyl)-1-piperazinyl]-6-[(4-methoxyphenyl)methylthio]pyrimidine IUPAC Name: 4-[4-(2-fluorophenyl)piperazin-1-yl]-6-[(4-methoxyphenyl)methylsulfanyl]pyrimidine Traditional Name: 4-[4-(2-fluorophenyl)piperazino]-6-(p-anisylthio)pyrimidine Formula: C22H23FN4OS MolecularWeight: 410.507623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC2=NC=NC(=C2)N3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

COC1=CC=C(C=C1)CSC2=NC=NC(=C2)N3CCN(CC3)C4=CC=CC=C4F

InChI

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