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

Systemtic Name: 5-chloranyl-2,6-dimethyl-N-[[3-methyl-4-[4-(pyridin-3-ylmethylsulfanyl)butoxy]pyridin-2-yl]methyl]pyrimidin-4-amine Openeye Name: 5-chloro-2,6-dimethyl-N-[[3-methyl-4-[4-(3-pyridylmethylsulfanyl)butoxy]-2-pyridyl]methyl]pyrimidin-4-amine CAS Name: 5-chloro-2,6-dimethyl-N-[[3-methyl-4-[4-(3-pyridinylmethylthio)butoxy]-2-pyridinyl]methyl]-4-pyrimidinamine IUPAC Name: 5-chloro-2,6-dimethyl-N-[[3-methyl-4-[4-(pyridin-3-ylmethylsulfanyl)butoxy]pyridin-2-yl]methyl]pyrimidin-4-amine Traditional Name: (5-chloro-2,6-dimethyl-pyrimidin-4-yl)-[[3-methyl-4-[4-(3-pyridylmethylthio)butoxy]-2-pyridyl]methyl]amine Formula: C23H28ClN5OS MolecularWeight: 458.01932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1CNC2=NC(=NC(=C2Cl)C)C)OCCCCSCC3=CN=CC=C3

Isomeric SMILES

CC1=C(C=CN=C1CNC2=NC(=NC(=C2Cl)C)C)OCCCCSCC3=CN=CC=C3

InChI

InChI=1S/C23H28ClN5OS/c1-16-20(14-27-23-22(24)17(2)28-18(3)29-23)26-10-8-21(16)30-11-4-5-12-31-15-19-7-6-9-25-13-19/h6-10,13H,4-5,11-12,14-15H2,1-3H3,(H,27,28,29)