4-(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonyl-N,N-diethyl-piperazine-1-carboxamide

Systemtic Name: 4-(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonyl-N,N-diethyl-piperazine-1-carboxamide Openeye Name: 4-(5-chloro-2-methylsulfanyl-pyrimidine-4-carbonyl)-N,N-diethyl-piperazine-1-carboxamide CAS Name: 4-[[5-chloro-2-(methylthio)-4-pyrimidinyl]-oxomethyl]-N,N-diethyl-1-piperazinecarboxamide IUPAC Name: 4-(5-chloro-2-methylsulfanylpyrimidine-4-carbonyl)-N,N-diethylpiperazine-1-carboxamide Traditional Name: 4-[5-chloro-2-(methylthio)pyrimidine-4-carbonyl]-N,N-diethyl-piperazine-1-carboxamide Formula: C15H22ClN5O2S MolecularWeight: 371.88548

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)N1CCN(CC1)C(=O)C2=NC(=NC=C2Cl)SC

Isomeric SMILES

CCN(CC)C(=O)N1CCN(CC1)C(=O)C2=NC(=NC=C2Cl)SC

InChI

InChI=1S/C15H22ClN5O2S/c1-4-19(5-2)15(23)21-8-6-20(7-9-21)13(22)12-11(16)10-17-14(18-12)24-3/h10H,4-9H2,1-3H3