ethyl 4-[2-[(4-ethoxycarbonyl-2-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(4-ethoxycarbonyl-2-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[(4-ethoxycarbonyl-2-phenyl-pyrazol-3-yl)amino]-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 4-[2-[(4-ethoxycarbonyl-2-phenyl-3-pyrazolyl)amino]-2-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(4-ethoxycarbonyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(4-carbethoxy-2-phenyl-pyrazol-3-yl)amino]-2-keto-ethyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H27N5O5 MolecularWeight: 429.46958

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)CN3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)CN3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C21H27N5O5/c1-3-30-20(28)17-14-22-26(16-8-6-5-7-9-16)19(17)23-18(27)15-24-10-12-25(13-11-24)21(29)31-4-2/h5-9,14H,3-4,10-13,15H2,1-2H3,(H,23,27)