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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(N1CCNCC1)SC2=C(C(=NC=C2)CNC3=NC(=NC(=C3Cl)C)C)C

Isomeric SMILES

CCC(N1CCNCC1)SC2=C(C(=NC=C2)CNC3=NC(=NC(=C3Cl)C)C)C

InChI

InChI=1S/C20H29ClN6S/c1-5-18(27-10-8-22-9-11-27)28-17-6-7-23-16(13(17)2)12-24-20-19(21)14(3)25-15(4)26-20/h6-7,18,22H,5,8-12H2,1-4H3,(H,24,25,26)