N-(3,4-diethoxyphenyl)-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxidanylidene-piperazin-1-yl]ethanamide

Systemtic Name: N-(3,4-diethoxyphenyl)-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxidanylidene-piperazin-1-yl]ethanamide Openeye Name: N-(3,4-diethoxyphenyl)-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxo-piperazin-1-yl]acetamide CAS Name: N-(3,4-diethoxyphenyl)-2-[2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-3-oxo-1-piperazinyl]acetamide IUPAC Name: N-(3,4-diethoxyphenyl)-2-[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-oxopiperazin-1-yl]acetamide Traditional Name: N-(3,4-diethoxyphenyl)-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-keto-piperazino]acetamide Formula: C27H33N5O4 MolecularWeight: 491.58202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CN2CCNC(=O)C2C3=C(N(N=C3C)C4=CC=CC=C4)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CN2CCNC(=O)C2C3=C(N(N=C3C)C4=CC=CC=C4)C)OCC

InChI

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