3-(2-methoxyphenyl)-1-[4-(7H-purin-6-yl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(2-methoxyphenyl)-1-[4-(7H-purin-6-yl)piperazin-1-yl]propan-1-one Openeye Name: 3-(2-methoxyphenyl)-1-[4-(7H-purin-6-yl)piperazin-1-yl]propan-1-one CAS Name: 3-(2-methoxyphenyl)-1-[4-(7H-purin-6-yl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(2-methoxyphenyl)-1-[4-(7H-purin-6-yl)piperazin-1-yl]propan-1-one Traditional Name: 3-(2-methoxyphenyl)-1-[4-(7H-purin-6-yl)piperazino]propan-1-one Formula: C19H22N6O2 MolecularWeight: 366.41698

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CCC(=O)N2CCN(CC2)C3=NC=NC4=C3NC=N4

Isomeric SMILES

COC1=CC=CC=C1CCC(=O)N2CCN(CC2)C3=NC=NC4=C3NC=N4

InChI

InChI=1S/C19H22N6O2/c1-27-15-5-3-2-4-14(15)6-7-16(26)24-8-10-25(11-9-24)19-17-18(21-12-20-17)22-13-23-19/h2-5,12-13H,6-11H2,1H3,(H,20,21,22,23)