ethyl 4-[3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]propanoyl]piperazine-1-carboxylate CAS Name: 4-[3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]propanoyl]piperazine-1-carboxylate Traditional Name: 4-[3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H27N5O3 MolecularWeight: 361.43868

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CCC2=C(N(N=C2C)CCC#N)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CCC2=C(N(N=C2C)CCC#N)C

InChI

InChI=1S/C18H27N5O3/c1-4-26-18(25)22-12-10-21(11-13-22)17(24)7-6-16-14(2)20-23(15(16)3)9-5-8-19/h4-7,9-13H2,1-3H3