4-ethoxy-N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-5-[(6-methylpyridin-3-yl)methyl]pyrimidin-2-amine

Systemtic Name: 4-ethoxy-N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-5-[(6-methylpyridin-3-yl)methyl]pyrimidin-2-amine Openeye Name: 4-ethoxy-N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-5-[(6-methyl-3-pyridyl)methyl]pyrimidin-2-amine CAS Name: 4-ethoxy-N-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]-5-[(6-methyl-3-pyridinyl)methyl]-2-pyrimidinamine IUPAC Name: 4-ethoxy-N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-5-[(6-methylpyridin-3-yl)methyl]pyrimidin-2-amine Traditional Name: [4-ethoxy-5-[(6-methyl-3-pyridyl)methyl]pyrimidin-2-yl]-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]amine Formula: C20H26N6OS MolecularWeight: 398.52504

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=NC=C1CC2=CN=C(C=C2)C)NCCSCC3=C(NC=N3)C

Isomeric SMILES

CCOC1=NC(=NC=C1CC2=CN=C(C=C2)C)NCCSCC3=C(NC=N3)C

InChI

InChI=1S/C20H26N6OS/c1-4-27-19-17(9-16-6-5-14(2)22-10-16)11-23-20(26-19)21-7-8-28-12-18-15(3)24-13-25-18/h5-6,10-11,13H,4,7-9,12H2,1-3H3,(H,24,25)(H,21,23,26)