5-ethyl-2-[4-[[5-(4-methylsulfonylpiperazin-1-yl)pyrazin-2-yl]oxymethyl]piperidin-1-yl]pyrimidine

Systemtic Name: 5-ethyl-2-[4-[[5-(4-methylsulfonylpiperazin-1-yl)pyrazin-2-yl]oxymethyl]piperidin-1-yl]pyrimidine Openeye Name: 5-ethyl-2-[4-[[5-(4-methylsulfonylpiperazin-1-yl)pyrazin-2-yl]oxymethyl]-1-piperidyl]pyrimidine CAS Name: 5-ethyl-2-[4-[[5-(4-methylsulfonyl-1-piperazinyl)-2-pyrazinyl]oxymethyl]-1-piperidinyl]pyrimidine IUPAC Name: 5-ethyl-2-[4-[[5-(4-methylsulfonylpiperazin-1-yl)pyrazin-2-yl]oxymethyl]piperidin-1-yl]pyrimidine Traditional Name: 5-ethyl-2-[4-[[5-(4-mesylpiperazino)pyrazin-2-yl]oxymethyl]piperidino]pyrimidine Formula: C21H31N7O3S MolecularWeight: 461.58094

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(N=C1)N2CCC(CC2)COC3=NC=C(N=C3)N4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

CCC1=CN=C(N=C1)N2CCC(CC2)COC3=NC=C(N=C3)N4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C21H31N7O3S/c1-3-17-12-24-21(25-13-17)27-6-4-18(5-7-27)16-31-20-15-22-19(14-23-20)26-8-10-28(11-9-26)32(2,29)30/h12-15,18H,3-11,16H2,1-2H3