2-[4-(2-azanylethyl)piperazin-1-yl]-6-(3-methoxyphenyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[4-(2-azanylethyl)piperazin-1-yl]-6-(3-methoxyphenyl)-1H-pyrimidin-4-one Openeye Name: 2-[4-(2-aminoethyl)piperazin-1-yl]-6-(3-methoxyphenyl)-1H-pyrimidin-4-one CAS Name: 2-[4-(2-aminoethyl)-1-piperazinyl]-6-(3-methoxyphenyl)-1H-pyrimidin-4-one IUPAC Name: 2-[4-(2-aminoethyl)piperazin-1-yl]-6-(3-methoxyphenyl)-1H-pyrimidin-4-one Traditional Name: 2-[4-(2-aminoethyl)piperazino]-6-(3-methoxyphenyl)-1H-pyrimidin-4-one Formula: C17H23N5O2 MolecularWeight: 329.39682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CC(=O)N=C(N2)N3CCN(CC3)CCN

Isomeric SMILES

COC1=CC=CC(=C1)C2=CC(=O)N=C(N2)N3CCN(CC3)CCN

InChI

InChI=1S/C17H23N5O2/c1-24-14-4-2-3-13(11-14)15-12-16(23)20-17(19-15)22-9-7-21(6-5-18)8-10-22/h2-4,11-12H,5-10,18H2,1H3,(H,19,20,23)