1-[(4-tert-butylphenoxy)methyl]-N-[1-(ethoxymethyl)pyrazol-4-yl]pyrazole-3-carboxamide

Systemtic Name: 1-[(4-tert-butylphenoxy)methyl]-N-[1-(ethoxymethyl)pyrazol-4-yl]pyrazole-3-carboxamide Openeye Name: 1-[(4-tert-butylphenoxy)methyl]-N-[1-(ethoxymethyl)pyrazol-4-yl]pyrazole-3-carboxamide CAS Name: 1-[(4-tert-butylphenoxy)methyl]-N-[1-(ethoxymethyl)-4-pyrazolyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-tert-butylphenoxy)methyl]-N-[1-(ethoxymethyl)pyrazol-4-yl]pyrazole-3-carboxamide Traditional Name: 1-[(4-tert-butylphenoxy)methyl]-N-[1-(ethoxymethyl)pyrazol-4-yl]pyrazole-3-carboxamide Formula: C21H27N5O3 MolecularWeight: 397.47078

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Descriptors Computed from Structure

Canonical SMILES:

CCOCN1C=C(C=N1)NC(=O)C2=NN(C=C2)COC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCOCN1C=C(C=N1)NC(=O)C2=NN(C=C2)COC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C21H27N5O3/c1-5-28-14-26-13-17(12-22-26)23-20(27)19-10-11-25(24-19)15-29-18-8-6-16(7-9-18)21(2,3)4/h6-13H,5,14-15H2,1-4H3,(H,23,27)