3-cyclohexyl-1-(4-methoxyphenyl)-1-[2-[[(2S)-1-methoxypropan-2-yl]amino]pyrimidin-4-yl]urea

Systemtic Name: 3-cyclohexyl-1-(4-methoxyphenyl)-1-[2-[[(2S)-1-methoxypropan-2-yl]amino]pyrimidin-4-yl]urea Openeye Name: 3-cyclohexyl-1-[2-[[(1S)-2-methoxy-1-methyl-ethyl]amino]pyrimidin-4-yl]-1-(4-methoxyphenyl)urea CAS Name: 3-cyclohexyl-1-(4-methoxyphenyl)-1-[2-[[(2S)-1-methoxypropan-2-yl]amino]-4-pyrimidinyl]urea IUPAC Name: 3-cyclohexyl-1-(4-methoxyphenyl)-1-[2-[[(2S)-1-methoxypropan-2-yl]amino]pyrimidin-4-yl]urea Traditional Name: 3-cyclohexyl-1-[2-[[(1S)-2-methoxy-1-methyl-ethyl]amino]pyrimidin-4-yl]-1-(4-methoxyphenyl)urea Formula: C22H31N5O3 MolecularWeight: 413.51324

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NC1=NC=CC(=N1)N(C2=CC=C(C=C2)OC)C(=O)NC3CCCCC3

Isomeric SMILES

C[C@@H](COC)NC1=NC=CC(=N1)N(C2=CC=C(C=C2)OC)C(=O)NC3CCCCC3

InChI

InChI=1S/C22H31N5O3/c1-16(15-29-2)24-21-23-14-13-20(26-21)27(18-9-11-19(30-3)12-10-18)22(28)25-17-7-5-4-6-8-17/h9-14,16-17H,4-8,15H2,1-3H3,(H,25,28)(H,23,24,26)/t16-/m0/s1