2-[4-(1-ethyl-3-methyl-pyrazol-4-yl)pyrimidin-2-yl]sulfanylethanamine

Systemtic Name: 2-[4-(1-ethyl-3-methyl-pyrazol-4-yl)pyrimidin-2-yl]sulfanylethanamine Openeye Name: 2-[4-(1-ethyl-3-methyl-pyrazol-4-yl)pyrimidin-2-yl]sulfanylethanamine CAS Name: 2-[[4-(1-ethyl-3-methyl-4-pyrazolyl)-2-pyrimidinyl]thio]ethanamine IUPAC Name: 2-[4-(1-ethyl-3-methylpyrazol-4-yl)pyrimidin-2-yl]sulfanylethanamine Traditional Name: 2-[[4-(1-ethyl-3-methyl-pyrazol-4-yl)pyrimidin-2-yl]thio]ethylamine Formula: C12H17N5S MolecularWeight: 263.36188

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)C2=NC(=NC=C2)SCCN

Isomeric SMILES

CCN1C=C(C(=N1)C)C2=NC(=NC=C2)SCCN

InChI

InChI=1S/C12H17N5S/c1-3-17-8-10(9(2)16-17)11-4-6-14-12(15-11)18-7-5-13/h4,6,8H,3,5,7,13H2,1-2H3