2-[3,5-dimethyl-4-(3-methylbutyl)pyrazol-1-yl]-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide

Systemtic Name: 2-[3,5-dimethyl-4-(3-methylbutyl)pyrazol-1-yl]-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide Openeye Name: 2-(4-isopentyl-3,5-dimethyl-pyrazol-1-yl)-4-methyl-N-phenyl-thiazole-5-carboxamide CAS Name: 2-[3,5-dimethyl-4-(3-methylbutyl)-1-pyrazolyl]-4-methyl-N-phenyl-5-thiazolecarboxamide IUPAC Name: 2-[3,5-dimethyl-4-(3-methylbutyl)pyrazol-1-yl]-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide Traditional Name: 2-(4-isoamyl-3,5-dimethyl-pyrazol-1-yl)-4-methyl-N-phenyl-thiazole-5-carboxamide Formula: C21H26N4OS MolecularWeight: 382.52234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N2C(=C(C(=N2)C)CCC(C)C)C)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(SC(=N1)N2C(=C(C(=N2)C)CCC(C)C)C)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H26N4OS/c1-13(2)11-12-18-14(3)24-25(16(18)5)21-22-15(4)19(27-21)20(26)23-17-9-7-6-8-10-17/h6-10,13H,11-12H2,1-5H3,(H,23,26)