N-[2-(1,3-benzothiazol-2-yl)-5-tert-butyl-4-cyano-pyrazol-3-yl]ethanamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)-5-tert-butyl-4-cyano-pyrazol-3-yl]ethanamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)-5-tert-butyl-4-cyano-pyrazol-3-yl]acetamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)-5-tert-butyl-4-cyano-3-pyrazolyl]acetamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)-5-tert-butyl-4-cyanopyrazol-3-yl]acetamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)-5-tert-butyl-4-cyano-pyrazol-3-yl]acetamide Formula: C17H17N5OS MolecularWeight: 339.41478

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C(=NN1C2=NC3=CC=CC=C3S2)C(C)(C)C)C#N

Isomeric SMILES

CC(=O)NC1=C(C(=NN1C2=NC3=CC=CC=C3S2)C(C)(C)C)C#N

InChI

InChI=1S/C17H17N5OS/c1-10(23)19-15-11(9-18)14(17(2,3)4)21-22(15)16-20-12-7-5-6-8-13(12)24-16/h5-8H,1-4H3,(H,19,23)