N-[(3,4-diethoxyphenyl)methyl]-1,3-diphenyl-pyrazole-4-carboxamide

Systemtic Name: N-[(3,4-diethoxyphenyl)methyl]-1,3-diphenyl-pyrazole-4-carboxamide Openeye Name: N-[(3,4-diethoxyphenyl)methyl]-1,3-diphenyl-pyrazole-4-carboxamide CAS Name: N-[(3,4-diethoxyphenyl)methyl]-1,3-diphenyl-4-pyrazolecarboxamide IUPAC Name: N-[(3,4-diethoxyphenyl)methyl]-1,3-diphenylpyrazole-4-carboxamide Traditional Name: N-(3,4-diethoxybenzyl)-1,3-diphenyl-pyrazole-4-carboxamide Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)OCC

InChI

InChI=1S/C27H27N3O3/c1-3-32-24-16-15-20(17-25(24)33-4-2)18-28-27(31)23-19-30(22-13-9-6-10-14-22)29-26(23)21-11-7-5-8-12-21/h5-17,19H,3-4,18H2,1-2H3,(H,28,31)