N-hexyl-1-(4-phenyl-1,3-thiazol-2-yl)-5-propyl-pyrazole-4-carboxamide

Systemtic Name: N-hexyl-1-(4-phenyl-1,3-thiazol-2-yl)-5-propyl-pyrazole-4-carboxamide Openeye Name: N-hexyl-1-(4-phenylthiazol-2-yl)-5-propyl-pyrazole-4-carboxamide CAS Name: N-hexyl-1-(4-phenyl-2-thiazolyl)-5-propyl-4-pyrazolecarboxamide IUPAC Name: N-hexyl-1-(4-phenyl-1,3-thiazol-2-yl)-5-propylpyrazole-4-carboxamide Traditional Name: N-hexyl-1-(4-phenylthiazol-2-yl)-5-propyl-pyrazole-4-carboxamide Formula: C22H28N4OS MolecularWeight: 396.54892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=C(N(N=C1)C2=NC(=CS2)C3=CC=CC=C3)CCC

Isomeric SMILES

CCCCCCNC(=O)C1=C(N(N=C1)C2=NC(=CS2)C3=CC=CC=C3)CCC

InChI

InChI=1S/C22H28N4OS/c1-3-5-6-10-14-23-21(27)18-15-24-26(20(18)11-4-2)22-25-19(16-28-22)17-12-8-7-9-13-17/h7-9,12-13,15-16H,3-6,10-11,14H2,1-2H3,(H,23,27)