ethyl 4-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidin-3-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidin-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidine-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[1-[(1,5-dimethyl-4-pyrazolyl)sulfonyl]-3-piperidinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidine-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[1-(1,5-dimethylpyrazol-4-yl)sulfonylnipecotoyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H29N5O5S MolecularWeight: 427.51836

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2CCCN(C2)S(=O)(=O)C3=C(N(N=C3)C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2CCCN(C2)S(=O)(=O)C3=C(N(N=C3)C)C

InChI

InChI=1S/C18H29N5O5S/c1-4-28-18(25)22-10-8-21(9-11-22)17(24)15-6-5-7-23(13-15)29(26,27)16-12-19-20(3)14(16)2/h12,15H,4-11,13H2,1-3H3