N-(4-bromophenyl)-2-[2-(4-butyl-3,5-dimethyl-pyrazol-1-yl)-1,3-thiazol-4-yl]ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[2-(4-butyl-3,5-dimethyl-pyrazol-1-yl)-1,3-thiazol-4-yl]ethanamide Openeye Name: N-(4-bromophenyl)-2-[2-(4-butyl-3,5-dimethyl-pyrazol-1-yl)thiazol-4-yl]acetamide CAS Name: N-(4-bromophenyl)-2-[2-(4-butyl-3,5-dimethyl-1-pyrazolyl)-4-thiazolyl]acetamide IUPAC Name: N-(4-bromophenyl)-2-[2-(4-butyl-3,5-dimethylpyrazol-1-yl)-1,3-thiazol-4-yl]acetamide Traditional Name: N-(4-bromophenyl)-2-[2-(4-butyl-3,5-dimethyl-pyrazol-1-yl)thiazol-4-yl]acetamide Formula: C20H23BrN4OS MolecularWeight: 447.39182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N(N=C1C)C2=NC(=CS2)CC(=O)NC3=CC=C(C=C3)Br)C

Isomeric SMILES

CCCCC1=C(N(N=C1C)C2=NC(=CS2)CC(=O)NC3=CC=C(C=C3)Br)C

InChI

InChI=1S/C20H23BrN4OS/c1-4-5-6-18-13(2)24-25(14(18)3)20-23-17(12-27-20)11-19(26)22-16-9-7-15(21)8-10-16/h7-10,12H,4-6,11H2,1-3H3,(H,22,26)