2-(chloromethylsulfanyl)-N,N-diethyl-1-pyrimidin-2-yl-imidazole-4-carboxamide

Systemtic Name: 2-(chloromethylsulfanyl)-N,N-diethyl-1-pyrimidin-2-yl-imidazole-4-carboxamide Openeye Name: 2-(chloromethylsulfanyl)-N,N-diethyl-1-pyrimidin-2-yl-imidazole-4-carboxamide CAS Name: 2-(chloromethylthio)-N,N-diethyl-1-(2-pyrimidinyl)-4-imidazolecarboxamide IUPAC Name: 2-(chloromethylsulfanyl)-N,N-diethyl-1-pyrimidin-2-ylimidazole-4-carboxamide Traditional Name: 2-(chloromethylthio)-N,N-diethyl-1-(2-pyrimidyl)imidazole-4-carboxamide Formula: C13H16ClN5OS MolecularWeight: 325.81704

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CN(C(=N1)SCCl)C2=NC=CC=N2

Isomeric SMILES

CCN(CC)C(=O)C1=CN(C(=N1)SCCl)C2=NC=CC=N2

InChI

InChI=1S/C13H16ClN5OS/c1-3-18(4-2)11(20)10-8-19(13(17-10)21-9-14)12-15-6-5-7-16-12/h5-8H,3-4,9H2,1-2H3