N-[1-(4-tert-butylphenyl)ethyl]-4-[(4-chloranylpyrazol-1-yl)methyl]-5-methyl-1,2-oxazole-3-carboxamide

Systemtic Name: N-[1-(4-tert-butylphenyl)ethyl]-4-[(4-chloranylpyrazol-1-yl)methyl]-5-methyl-1,2-oxazole-3-carboxamide Openeye Name: N-[1-(4-tert-butylphenyl)ethyl]-4-[(4-chloropyrazol-1-yl)methyl]-5-methyl-isoxazole-3-carboxamide CAS Name: N-[1-(4-tert-butylphenyl)ethyl]-4-[(4-chloro-1-pyrazolyl)methyl]-5-methyl-3-isoxazolecarboxamide IUPAC Name: N-[1-(4-tert-butylphenyl)ethyl]-4-[(4-chloropyrazol-1-yl)methyl]-5-methyl-1,2-oxazole-3-carboxamide Traditional Name: N-[1-(4-tert-butylphenyl)ethyl]-4-[(4-chloropyrazol-1-yl)methyl]-5-methyl-isoxazole-3-carboxamide Formula: C21H25ClN4O2 MolecularWeight: 400.9018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C(=O)NC(C)C2=CC=C(C=C2)C(C)(C)C)CN3C=C(C=N3)Cl

Isomeric SMILES

CC1=C(C(=NO1)C(=O)NC(C)C2=CC=C(C=C2)C(C)(C)C)CN3C=C(C=N3)Cl

InChI

InChI=1S/C21H25ClN4O2/c1-13(15-6-8-16(9-7-15)21(3,4)5)24-20(27)19-18(14(2)28-25-19)12-26-11-17(22)10-23-26/h6-11,13H,12H2,1-5H3,(H,24,27)