2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[[2-(4-methoxyphenyl)-5-methyl-oxazol-4-yl]methylsulfanyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[[2-(4-methoxyphenyl)-5-methyl-4-oxazolyl]methylthio]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[[2-(4-methoxyphenyl)-5-methyl-oxazol-4-yl]methylthio]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C22H25N5O3S MolecularWeight: 439.5306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=C(C=C2)OC)CSCC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=C(C=C2)OC)CSCC(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C22H25N5O3S/c1-16-19(25-21(30-16)17-4-6-18(29-2)7-5-17)14-31-15-20(28)26-10-12-27(13-11-26)22-23-8-3-9-24-22/h3-9H,10-15H2,1-2H3