N-(2-cyclohexylsulfanylethyl)-4-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-2-amine

Systemtic Name: N-(2-cyclohexylsulfanylethyl)-4-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-2-amine Openeye Name: N-(2-cyclohexylsulfanylethyl)-4-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-2-amine CAS Name: N-[2-(cyclohexylthio)ethyl]-4-(1,3,5-trimethyl-4-pyrazolyl)-2-pyrimidinamine IUPAC Name: N-(2-cyclohexylsulfanylethyl)-4-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-2-amine Traditional Name: 2-(cyclohexylthio)ethyl-[4-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-2-yl]amine Formula: C18H27N5S MolecularWeight: 345.50548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C2=NC(=NC=C2)NCCSC3CCCCC3

Isomeric SMILES

CC1=C(C(=NN1C)C)C2=NC(=NC=C2)NCCSC3CCCCC3

InChI

InChI=1S/C18H27N5S/c1-13-17(14(2)23(3)22-13)16-9-10-19-18(21-16)20-11-12-24-15-7-5-4-6-8-15/h9-10,15H,4-8,11-12H2,1-3H3,(H,19,20,21)