ethyl 4-[(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[(5-chloro-2-methylsulfanyl-pyrimidine-4-carbonyl)amino]piperidine-1-carboxylate CAS Name: 4-[[[5-chloro-2-(methylthio)-4-pyrimidinyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(5-chloro-2-methylsulfanylpyrimidine-4-carbonyl)amino]piperidine-1-carboxylate Traditional Name: 4-[[5-chloro-2-(methylthio)pyrimidine-4-carbonyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C14H19ClN4O3S MolecularWeight: 358.84366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=NC(=NC=C2Cl)SC

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=NC(=NC=C2Cl)SC

InChI

InChI=1S/C14H19ClN4O3S/c1-3-22-14(21)19-6-4-9(5-7-19)17-12(20)11-10(15)8-16-13(18-11)23-2/h8-9H,3-7H2,1-2H3,(H,17,20)