5-chloranyl-2,6-dimethyl-N-[[3-methyl-4-(4-pyrimidin-2-ylsulfanylbutoxy)pyridin-2-yl]methyl]pyrimidin-4-amine

Systemtic Name: 5-chloranyl-2,6-dimethyl-N-[[3-methyl-4-(4-pyrimidin-2-ylsulfanylbutoxy)pyridin-2-yl]methyl]pyrimidin-4-amine Openeye Name: 5-chloro-2,6-dimethyl-N-[[3-methyl-4-(4-pyrimidin-2-ylsulfanylbutoxy)-2-pyridyl]methyl]pyrimidin-4-amine CAS Name: 5-chloro-2,6-dimethyl-N-[[3-methyl-4-[4-(2-pyrimidinylthio)butoxy]-2-pyridinyl]methyl]-4-pyrimidinamine IUPAC Name: 5-chloro-2,6-dimethyl-N-[[3-methyl-4-(4-pyrimidin-2-ylsulfanylbutoxy)pyridin-2-yl]methyl]pyrimidin-4-amine Traditional Name: (5-chloro-2,6-dimethyl-pyrimidin-4-yl)-[[3-methyl-4-[4-(2-pyrimidylthio)butoxy]-2-pyridyl]methyl]amine Formula: C21H25ClN6OS MolecularWeight: 444.9808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1CNC2=NC(=NC(=C2Cl)C)C)OCCCCSC3=NC=CC=N3

Isomeric SMILES

CC1=C(C=CN=C1CNC2=NC(=NC(=C2Cl)C)C)OCCCCSC3=NC=CC=N3

InChI

InChI=1S/C21H25ClN6OS/c1-14-17(13-26-20-19(22)15(2)27-16(3)28-20)23-10-7-18(14)29-11-4-5-12-30-21-24-8-6-9-25-21/h6-10H,4-5,11-13H2,1-3H3,(H,26,27,28)