ethyl 4-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonylpiperazine-1-carboxylate CAS Name: 4-[(5-chloro-1,3-dimethyl-4-pyrazolyl)sulfonyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(5-chloro-1,3-dimethylpyrazol-4-yl)sulfonylpiperazine-1-carboxylate Traditional Name: 4-(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonylpiperazine-1-carboxylic acid ethyl ester Formula: C12H19ClN4O4S MolecularWeight: 350.82166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=C(N(N=C2C)C)Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=C(N(N=C2C)C)Cl

InChI

InChI=1S/C12H19ClN4O4S/c1-4-21-12(18)16-5-7-17(8-6-16)22(19,20)10-9(2)14-15(3)11(10)13/h4-8H2,1-3H3