N-[(4-chloranyl-1-methyl-pyrazol-3-yl)methyl]-N-(2-morpholin-4-ylethyl)-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[(4-chloranyl-1-methyl-pyrazol-3-yl)methyl]-N-(2-morpholin-4-ylethyl)-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-[(4-chloro-1-methyl-pyrazol-3-yl)methyl]-N-(2-morpholinoethyl)-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-[(4-chloro-1-methyl-3-pyrazolyl)methyl]-N-[2-(4-morpholinyl)ethyl]-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-[(4-chloro-1-methylpyrazol-3-yl)methyl]-N-(2-morpholin-4-ylethyl)-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-[(4-chloro-1-methyl-pyrazol-3-yl)methyl]-N-(2-morpholinoethyl)-2-(2-pyrimidylthio)acetamide Formula: C17H23ClN6O2S MolecularWeight: 410.92152

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)CN(CCN2CCOCC2)C(=O)CSC3=NC=CC=N3)Cl

Isomeric SMILES

CN1C=C(C(=N1)CN(CCN2CCOCC2)C(=O)CSC3=NC=CC=N3)Cl

InChI

InChI=1S/C17H23ClN6O2S/c1-22-11-14(18)15(21-22)12-24(6-5-23-7-9-26-10-8-23)16(25)13-27-17-19-3-2-4-20-17/h2-4,11H,5-10,12-13H2,1H3