7-[[4-[2-(4-methoxyphenoxy)ethanoyl]piperazin-1-yl]methyl]-2-(2-methylphenyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one

Systemtic Name: 7-[[4-[2-(4-methoxyphenoxy)ethanoyl]piperazin-1-yl]methyl]-2-(2-methylphenyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one Openeye Name: 7-[[4-[2-(4-methoxyphenoxy)acetyl]piperazin-1-yl]methyl]-2-(o-tolyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one CAS Name: 7-[[4-[2-(4-methoxyphenoxy)-1-oxoethyl]-1-piperazinyl]methyl]-2-(2-methylphenyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one IUPAC Name: 7-[[4-[2-(4-methoxyphenoxy)acetyl]piperazin-1-yl]methyl]-2-(2-methylphenyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one Traditional Name: 7-[[4-[2-(4-methoxyphenoxy)acetyl]piperazino]methyl]-2-(o-tolyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one Formula: C26H27N5O4S MolecularWeight: 505.58868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN3C(=O)C=C(N=C3S2)CN4CCN(CC4)C(=O)COC5=CC=C(C=C5)OC

Isomeric SMILES

CC1=CC=CC=C1C2=NN3C(=O)C=C(N=C3S2)CN4CCN(CC4)C(=O)COC5=CC=C(C=C5)OC

InChI

InChI=1S/C26H27N5O4S/c1-18-5-3-4-6-22(18)25-28-31-23(32)15-19(27-26(31)36-25)16-29-11-13-30(14-12-29)24(33)17-35-21-9-7-20(34-2)8-10-21/h3-10,15H,11-14,16-17H2,1-2H3