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

Systemtic Name: 3-cyclohexyl-1-[2-[[(2S)-1-methoxypropan-2-yl]amino]pyrimidin-4-yl]-1-(3-methylphenyl)urea Openeye Name: 3-cyclohexyl-1-[2-[[(1S)-2-methoxy-1-methyl-ethyl]amino]pyrimidin-4-yl]-1-(m-tolyl)urea CAS Name: 3-cyclohexyl-1-[2-[[(2S)-1-methoxypropan-2-yl]amino]-4-pyrimidinyl]-1-(3-methylphenyl)urea IUPAC Name: 3-cyclohexyl-1-[2-[[(2S)-1-methoxypropan-2-yl]amino]pyrimidin-4-yl]-1-(3-methylphenyl)urea Traditional Name: 3-cyclohexyl-1-[2-[[(1S)-2-methoxy-1-methyl-ethyl]amino]pyrimidin-4-yl]-1-(m-tolyl)urea Formula: C22H31N5O2 MolecularWeight: 397.51384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(C2=NC(=NC=C2)NC(C)COC)C(=O)NC3CCCCC3

Isomeric SMILES

CC1=CC(=CC=C1)N(C2=NC(=NC=C2)N[C@@H](C)COC)C(=O)NC3CCCCC3

InChI

InChI=1S/C22H31N5O2/c1-16-8-7-11-19(14-16)27(22(28)25-18-9-5-4-6-10-18)20-12-13-23-21(26-20)24-17(2)15-29-3/h7-8,11-14,17-18H,4-6,9-10,15H2,1-3H3,(H,25,28)(H,23,24,26)/t17-/m0/s1