N-[(2-chloranyl-6-methyl-phenyl)methyl]-4-[(3S)-3-phenylmorpholin-4-yl]pyrimidin-2-amine

Systemtic Name: N-[(2-chloranyl-6-methyl-phenyl)methyl]-4-[(3S)-3-phenylmorpholin-4-yl]pyrimidin-2-amine Openeye Name: N-[(2-chloro-6-methyl-phenyl)methyl]-4-[(3S)-3-phenylmorpholin-4-yl]pyrimidin-2-amine CAS Name: N-[(2-chloro-6-methylphenyl)methyl]-4-[(3S)-3-phenyl-4-morpholinyl]-2-pyrimidinamine IUPAC Name: N-[(2-chloro-6-methylphenyl)methyl]-4-[(3S)-3-phenylmorpholin-4-yl]pyrimidin-2-amine Traditional Name: (2-chloro-6-methyl-benzyl)-[4-[(3S)-3-phenylmorpholino]pyrimidin-2-yl]amine Formula: C22H23ClN4O MolecularWeight: 394.89722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Cl)CNC2=NC=CC(=N2)N3CCOCC3C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)CNC2=NC=CC(=N2)N3CCOC[C@@H]3C4=CC=CC=C4

InChI

InChI=1S/C22H23ClN4O/c1-16-6-5-9-19(23)18(16)14-25-22-24-11-10-21(26-22)27-12-13-28-15-20(27)17-7-3-2-4-8-17/h2-11,20H,12-15H2,1H3,(H,24,25,26)/t20-/m1/s1