2-(2,5-dimethylphenyl)-N-(3-methylbutyl)-5-thiophen-2-yl-pyrazole-3-carboxamide

Systemtic Name: 2-(2,5-dimethylphenyl)-N-(3-methylbutyl)-5-thiophen-2-yl-pyrazole-3-carboxamide Openeye Name: 2-(2,5-dimethylphenyl)-N-isopentyl-5-(2-thienyl)pyrazole-3-carboxamide CAS Name: 2-(2,5-dimethylphenyl)-N-(3-methylbutyl)-5-thiophen-2-yl-3-pyrazolecarboxamide IUPAC Name: 2-(2,5-dimethylphenyl)-N-(3-methylbutyl)-5-thiophen-2-ylpyrazole-3-carboxamide Traditional Name: 2-(2,5-dimethylphenyl)-N-isoamyl-5-(2-thienyl)pyrazole-3-carboxamide Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=CC(=N2)C3=CC=CS3)C(=O)NCCC(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=CC(=N2)C3=CC=CS3)C(=O)NCCC(C)C

InChI

InChI=1S/C21H25N3OS/c1-14(2)9-10-22-21(25)19-13-17(20-6-5-11-26-20)23-24(19)18-12-15(3)7-8-16(18)4/h5-8,11-14H,9-10H2,1-4H3,(H,22,25)