N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2,4-dimethylphenyl)-5-thiophen-2-yl-pyrazole-3-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2,4-dimethylphenyl)-5-thiophen-2-yl-pyrazole-3-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2,4-dimethylphenyl)-5-(2-thienyl)pyrazole-3-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2,4-dimethylphenyl)-5-thiophen-2-yl-3-pyrazolecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2,4-dimethylphenyl)-5-thiophen-2-ylpyrazole-3-carboxamide Traditional Name: 2-(2,4-dimethylphenyl)-N-homoveratryl-5-(2-thienyl)pyrazole-3-carboxamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=CC(=N2)C3=CC=CS3)C(=O)NCCC4=CC(=C(C=C4)OC)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=CC(=N2)C3=CC=CS3)C(=O)NCCC4=CC(=C(C=C4)OC)OC)C

InChI

InChI=1S/C26H27N3O3S/c1-17-7-9-21(18(2)14-17)29-22(16-20(28-29)25-6-5-13-33-25)26(30)27-12-11-19-8-10-23(31-3)24(15-19)32-4/h5-10,13-16H,11-12H2,1-4H3,(H,27,30)