4-chloranyl-6-[4-(2-methoxyphenyl)piperazin-1-yl]-2-methylsulfanyl-5-phenyl-pyrimidine

Systemtic Name: 4-chloranyl-6-[4-(2-methoxyphenyl)piperazin-1-yl]-2-methylsulfanyl-5-phenyl-pyrimidine Openeye Name: 4-chloro-6-[4-(2-methoxyphenyl)piperazin-1-yl]-2-methylsulfanyl-5-phenyl-pyrimidine CAS Name: 4-chloro-6-[4-(2-methoxyphenyl)-1-piperazinyl]-2-(methylthio)-5-phenylpyrimidine IUPAC Name: 4-chloro-6-[4-(2-methoxyphenyl)piperazin-1-yl]-2-methylsulfanyl-5-phenylpyrimidine Traditional Name: 4-chloro-6-[4-(2-methoxyphenyl)piperazino]-2-(methylthio)-5-phenyl-pyrimidine Formula: C22H23ClN4OS MolecularWeight: 426.96222

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3=C(C(=NC(=N3)SC)Cl)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3=C(C(=NC(=N3)SC)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H23ClN4OS/c1-28-18-11-7-6-10-17(18)26-12-14-27(15-13-26)21-19(16-8-4-3-5-9-16)20(23)24-22(25-21)29-2/h3-11H,12-15H2,1-2H3