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

Systemtic Name: 5-chloranyl-2,6-dimethyl-N-[[3-methyl-4-[3-(pyridin-4-ylmethylsulfanyl)propoxy]pyridin-2-yl]methyl]pyrimidin-4-amine Openeye Name: 5-chloro-2,6-dimethyl-N-[[3-methyl-4-[3-(4-pyridylmethylsulfanyl)propoxy]-2-pyridyl]methyl]pyrimidin-4-amine CAS Name: 5-chloro-2,6-dimethyl-N-[[3-methyl-4-[3-(pyridin-4-ylmethylthio)propoxy]-2-pyridinyl]methyl]-4-pyrimidinamine IUPAC Name: 5-chloro-2,6-dimethyl-N-[[3-methyl-4-[3-(pyridin-4-ylmethylsulfanyl)propoxy]pyridin-2-yl]methyl]pyrimidin-4-amine Traditional Name: (5-chloro-2,6-dimethyl-pyrimidin-4-yl)-[[3-methyl-4-[3-(4-pyridylmethylthio)propoxy]-2-pyridyl]methyl]amine Formula: C22H26ClN5OS MolecularWeight: 443.99274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1CNC2=NC(=NC(=C2Cl)C)C)OCCCSCC3=CC=NC=C3

Isomeric SMILES

CC1=C(C=CN=C1CNC2=NC(=NC(=C2Cl)C)C)OCCCSCC3=CC=NC=C3

InChI

InChI=1S/C22H26ClN5OS/c1-15-19(13-26-22-21(23)16(2)27-17(3)28-22)25-10-7-20(15)29-11-4-12-30-14-18-5-8-24-9-6-18/h5-10H,4,11-14H2,1-3H3,(H,26,27,28)