(3,4-diethoxyphenyl)-[4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]piperazin-1-yl]methanone

Systemtic Name: (3,4-diethoxyphenyl)-[4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]piperazin-1-yl]methanone Openeye Name: (3,4-diethoxyphenyl)-[4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]piperazin-1-yl]methanone CAS Name: (3,4-diethoxyphenyl)-[4-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-1-piperazinyl]methanone IUPAC Name: (3,4-diethoxyphenyl)-[4-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]piperazin-1-yl]methanone Traditional Name: (3,4-diethoxyphenyl)-[4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]piperazino]methanone Formula: C27H34N4O3 MolecularWeight: 462.58386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=C(N(N=C3C)C4=CC=CC=C4)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=C(N(N=C3C)C4=CC=CC=C4)C)OCC

InChI

InChI=1S/C27H34N4O3/c1-5-33-25-13-12-22(18-26(25)34-6-2)27(32)30-16-14-29(15-17-30)19-24-20(3)28-31(21(24)4)23-10-8-7-9-11-23/h7-13,18H,5-6,14-17,19H2,1-4H3