1-[2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethylamino]-4,6-dimethyl-pyrimidin-5-yl]-2-oxidanyl-ethanone

Systemtic Name: 1-[2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethylamino]-4,6-dimethyl-pyrimidin-5-yl]-2-oxidanyl-ethanone Openeye Name: 2-hydroxy-1-[2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethylamino]-4,6-dimethyl-pyrimidin-5-yl]ethanone CAS Name: 2-hydroxy-1-[2-[2-[4-(2-methoxyphenyl)-1-piperazinyl]ethylamino]-4,6-dimethyl-5-pyrimidinyl]ethanone IUPAC Name: 2-hydroxy-1-[2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethylamino]-4,6-dimethylpyrimidin-5-yl]ethanone Traditional Name: 2-hydroxy-1-[2-[2-[4-(2-methoxyphenyl)piperazino]ethylamino]-4,6-dimethyl-pyrimidin-5-yl]ethanone Formula: C21H29N5O3 MolecularWeight: 399.48666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)NCCN2CCN(CC2)C3=CC=CC=C3OC)C)C(=O)CO

Isomeric SMILES

CC1=C(C(=NC(=N1)NCCN2CCN(CC2)C3=CC=CC=C3OC)C)C(=O)CO

InChI

InChI=1S/C21H29N5O3/c1-15-20(18(28)14-27)16(2)24-21(23-15)22-8-9-25-10-12-26(13-11-25)17-6-4-5-7-19(17)29-3/h4-7,27H,8-14H2,1-3H3,(H,22,23,24)