5-chloranyl-2,6-dimethyl-N-[[3-methyl-4-(3-piperazin-1-ylpropylsulfanyl)pyridin-2-yl]methyl]pyrimidin-4-amine

Systemtic Name: 5-chloranyl-2,6-dimethyl-N-[[3-methyl-4-(3-piperazin-1-ylpropylsulfanyl)pyridin-2-yl]methyl]pyrimidin-4-amine Openeye Name: 5-chloro-2,6-dimethyl-N-[[3-methyl-4-(3-piperazin-1-ylpropylsulfanyl)-2-pyridyl]methyl]pyrimidin-4-amine CAS Name: 5-chloro-2,6-dimethyl-N-[[3-methyl-4-[3-(1-piperazinyl)propylthio]-2-pyridinyl]methyl]-4-pyrimidinamine IUPAC Name: 5-chloro-2,6-dimethyl-N-[[3-methyl-4-(3-piperazin-1-ylpropylsulfanyl)pyridin-2-yl]methyl]pyrimidin-4-amine Traditional Name: (5-chloro-2,6-dimethyl-pyrimidin-4-yl)-[[3-methyl-4-(3-piperazinopropylthio)-2-pyridyl]methyl]amine Formula: C20H29ClN6S MolecularWeight: 421.00246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1CNC2=NC(=NC(=C2Cl)C)C)SCCCN3CCNCC3

Isomeric SMILES

CC1=C(C=CN=C1CNC2=NC(=NC(=C2Cl)C)C)SCCCN3CCNCC3

InChI

InChI=1S/C20H29ClN6S/c1-14-17(13-24-20-19(21)15(2)25-16(3)26-20)23-6-5-18(14)28-12-4-9-27-10-7-22-8-11-27/h5-6,22H,4,7-13H2,1-3H3,(H,24,25,26)