1-[(4-tert-butylphenoxy)methyl]-N-[3-(4-chloranylpyrazol-1-yl)propyl]pyrazole-3-carboxamide

Systemtic Name: 1-[(4-tert-butylphenoxy)methyl]-N-[3-(4-chloranylpyrazol-1-yl)propyl]pyrazole-3-carboxamide Openeye Name: 1-[(4-tert-butylphenoxy)methyl]-N-[3-(4-chloropyrazol-1-yl)propyl]pyrazole-3-carboxamide CAS Name: 1-[(4-tert-butylphenoxy)methyl]-N-[3-(4-chloro-1-pyrazolyl)propyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-tert-butylphenoxy)methyl]-N-[3-(4-chloropyrazol-1-yl)propyl]pyrazole-3-carboxamide Traditional Name: 1-[(4-tert-butylphenoxy)methyl]-N-[3-(4-chloropyrazol-1-yl)propyl]pyrazole-3-carboxamide Formula: C21H26ClN5O2 MolecularWeight: 415.91644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCN2C=CC(=N2)C(=O)NCCCN3C=C(C=N3)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCN2C=CC(=N2)C(=O)NCCCN3C=C(C=N3)Cl

InChI

InChI=1S/C21H26ClN5O2/c1-21(2,3)16-5-7-18(8-6-16)29-15-27-12-9-19(25-27)20(28)23-10-4-11-26-14-17(22)13-24-26/h5-9,12-14H,4,10-11,15H2,1-3H3,(H,23,28)