4-[2-[[2-(dimethylsulfamoylamino)-2-piperidin-1-yl-cyclohexyl]amino]pyrimidin-4-yl]azepane

Systemtic Name: 4-[2-[[2-(dimethylsulfamoylamino)-2-piperidin-1-yl-cyclohexyl]amino]pyrimidin-4-yl]azepane Openeye Name: 4-[2-[[2-(dimethylsulfamoylamino)-2-(1-piperidyl)cyclohexyl]amino]pyrimidin-4-yl]azepane CAS Name: 4-[2-[[2-(dimethylsulfamoylamino)-2-(1-piperidinyl)cyclohexyl]amino]-4-pyrimidinyl]azepane IUPAC Name: 4-[2-[[2-(dimethylsulfamoylamino)-2-piperidin-1-ylcyclohexyl]amino]pyrimidin-4-yl]azepane Traditional Name: 4-[2-[[2-(dimethylsulfamoylamino)-2-piperidino-cyclohexyl]amino]pyrimidin-4-yl]azepane Formula: C23H41N7O2S MolecularWeight: 479.68234

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)NC1(CCCCC1NC2=NC=CC(=N2)C3CCCNCC3)N4CCCCC4

Isomeric SMILES

CN(C)S(=O)(=O)NC1(CCCCC1NC2=NC=CC(=N2)C3CCCNCC3)N4CCCCC4

InChI

InChI=1S/C23H41N7O2S/c1-29(2)33(31,32)28-23(30-17-6-3-7-18-30)13-5-4-10-21(23)27-22-25-16-12-20(26-22)19-9-8-14-24-15-11-19/h12,16,19,21,24,28H,3-11,13-15,17-18H2,1-2H3,(H,25,26,27)