N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-1-ethyl-3,5-dimethyl-pyrazole-4-carboxamide

Systemtic Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-1-ethyl-3,5-dimethyl-pyrazole-4-carboxamide Openeye Name: N-[4-(1-adamantyl)thiazol-2-yl]-1-ethyl-3,5-dimethyl-pyrazole-4-carboxamide CAS Name: N-[4-(1-adamantyl)-2-thiazolyl]-1-ethyl-3,5-dimethyl-4-pyrazolecarboxamide IUPAC Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-1-ethyl-3,5-dimethylpyrazole-4-carboxamide Traditional Name: N-[4-(1-adamantyl)thiazol-2-yl]-1-ethyl-3,5-dimethyl-pyrazole-4-carboxamide Formula: C21H28N4OS MolecularWeight: 384.53822

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)C(=O)NC2=NC(=CS2)C34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)C(=O)NC2=NC(=CS2)C34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C21H28N4OS/c1-4-25-13(3)18(12(2)24-25)19(26)23-20-22-17(11-27-20)21-8-14-5-15(9-21)7-16(6-14)10-21/h11,14-16H,4-10H2,1-3H3,(H,22,23,26)