4-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]carbonyl-N,N-diethyl-piperazine-1-carboxamide

Systemtic Name: 4-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]carbonyl-N,N-diethyl-piperazine-1-carboxamide Openeye Name: 4-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-4-carbonyl]-N,N-diethyl-piperazine-1-carboxamide CAS Name: 4-[[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]-oxomethyl]-N,N-diethyl-1-piperazinecarboxamide IUPAC Name: 4-[3-(3,4-dimethoxyphenyl)-1-phenylpyrazole-4-carbonyl]-N,N-diethylpiperazine-1-carboxamide Traditional Name: 4-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-4-carbonyl]-N,N-diethyl-piperazine-1-carboxamide Formula: C27H33N5O4 MolecularWeight: 491.58202

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)N1CCN(CC1)C(=O)C2=CN(N=C2C3=CC(=C(C=C3)OC)OC)C4=CC=CC=C4

Isomeric SMILES

CCN(CC)C(=O)N1CCN(CC1)C(=O)C2=CN(N=C2C3=CC(=C(C=C3)OC)OC)C4=CC=CC=C4

InChI

InChI=1S/C27H33N5O4/c1-5-29(6-2)27(34)31-16-14-30(15-17-31)26(33)22-19-32(21-10-8-7-9-11-21)28-25(22)20-12-13-23(35-3)24(18-20)36-4/h7-13,18-19H,5-6,14-17H2,1-4H3