5-ethyl-2-[4-[4-[(4-methylsulfonylpiperazin-1-yl)methyl]phenoxy]piperidin-1-yl]pyrimidine

Systemtic Name: 5-ethyl-2-[4-[4-[(4-methylsulfonylpiperazin-1-yl)methyl]phenoxy]piperidin-1-yl]pyrimidine Openeye Name: 5-ethyl-2-[4-[4-[(4-methylsulfonylpiperazin-1-yl)methyl]phenoxy]-1-piperidyl]pyrimidine CAS Name: 5-ethyl-2-[4-[4-[(4-methylsulfonyl-1-piperazinyl)methyl]phenoxy]-1-piperidinyl]pyrimidine IUPAC Name: 5-ethyl-2-[4-[4-[(4-methylsulfonylpiperazin-1-yl)methyl]phenoxy]piperidin-1-yl]pyrimidine Traditional Name: 5-ethyl-2-[4-[4-[(4-mesylpiperazino)methyl]phenoxy]piperidino]pyrimidine Formula: C23H33N5O3S MolecularWeight: 459.60482

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(N=C1)N2CCC(CC2)OC3=CC=C(C=C3)CN4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

CCC1=CN=C(N=C1)N2CCC(CC2)OC3=CC=C(C=C3)CN4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C23H33N5O3S/c1-3-19-16-24-23(25-17-19)27-10-8-22(9-11-27)31-21-6-4-20(5-7-21)18-26-12-14-28(15-13-26)32(2,29)30/h4-7,16-17,22H,3,8-15,18H2,1-2H3