1-[2-[[(2S)-3-methyl-3-oxidanyl-butan-2-yl]amino]pyrimidin-4-yl]-3-(2-methylphenyl)-1-phenyl-urea

Systemtic Name: 1-[2-[[(2S)-3-methyl-3-oxidanyl-butan-2-yl]amino]pyrimidin-4-yl]-3-(2-methylphenyl)-1-phenyl-urea Openeye Name: 1-[2-[[(1S)-2-hydroxy-1,2-dimethyl-propyl]amino]pyrimidin-4-yl]-3-(o-tolyl)-1-phenyl-urea CAS Name: 1-[2-[[(2S)-3-hydroxy-3-methylbutan-2-yl]amino]-4-pyrimidinyl]-3-(2-methylphenyl)-1-phenylurea IUPAC Name: 1-[2-[[(2S)-3-hydroxy-3-methylbutan-2-yl]amino]pyrimidin-4-yl]-3-(2-methylphenyl)-1-phenylurea Traditional Name: 1-[2-[[(1S)-2-hydroxy-1,2-dimethyl-propyl]amino]pyrimidin-4-yl]-3-(o-tolyl)-1-phenyl-urea Formula: C23H27N5O2 MolecularWeight: 405.49278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)N(C2=CC=CC=C2)C3=NC(=NC=C3)NC(C)C(C)(C)O

Isomeric SMILES

CC1=CC=CC=C1NC(=O)N(C2=CC=CC=C2)C3=NC(=NC=C3)N[C@@H](C)C(C)(C)O

InChI

InChI=1S/C23H27N5O2/c1-16-10-8-9-13-19(16)26-22(29)28(18-11-6-5-7-12-18)20-14-15-24-21(27-20)25-17(2)23(3,4)30/h5-15,17,30H,1-4H3,(H,26,29)(H,24,25,27)/t17-/m0/s1