1-cycloheptyl-N-[[4-(4-methylpiperazin-1-yl)-2-methylsulfanyl-pyrimidin-5-yl]methyl]methanamine

Systemtic Name: 1-cycloheptyl-N-[[4-(4-methylpiperazin-1-yl)-2-methylsulfanyl-pyrimidin-5-yl]methyl]methanamine Openeye Name: 1-cycloheptyl-N-[[4-(4-methylpiperazin-1-yl)-2-methylsulfanyl-pyrimidin-5-yl]methyl]methanamine CAS Name: 1-cycloheptyl-N-[[4-(4-methyl-1-piperazinyl)-2-(methylthio)-5-pyrimidinyl]methyl]methanamine IUPAC Name: 1-cycloheptyl-N-[[4-(4-methylpiperazin-1-yl)-2-methylsulfanylpyrimidin-5-yl]methyl]methanamine Traditional Name: cycloheptylmethyl-[[4-(4-methylpiperazino)-2-(methylthio)pyrimidin-5-yl]methyl]amine Formula: C19H33N5S MolecularWeight: 363.56382

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=NC=C2CNCC3CCCCCC3)SC

Isomeric SMILES

CN1CCN(CC1)C2=NC(=NC=C2CNCC3CCCCCC3)SC

InChI

InChI=1S/C19H33N5S/c1-23-9-11-24(12-10-23)18-17(15-21-19(22-18)25-2)14-20-13-16-7-5-3-4-6-8-16/h15-16,20H,3-14H2,1-2H3