5-[5-(aminomethyl)pyridin-2-yl]-N-tert-butyl-1-phenyl-pyrazole-3-carboxamide

Systemtic Name: 5-[5-(aminomethyl)pyridin-2-yl]-N-tert-butyl-1-phenyl-pyrazole-3-carboxamide Openeye Name: 5-[5-(aminomethyl)-2-pyridyl]-N-tert-butyl-1-phenyl-pyrazole-3-carboxamide CAS Name: 5-[5-(aminomethyl)-2-pyridinyl]-N-tert-butyl-1-phenyl-3-pyrazolecarboxamide IUPAC Name: 5-[5-(aminomethyl)pyridin-2-yl]-N-tert-butyl-1-phenylpyrazole-3-carboxamide Traditional Name: 5-[5-(aminomethyl)-2-pyridyl]-N-tert-butyl-1-phenyl-pyrazole-3-carboxamide Formula: C20H23N5O MolecularWeight: 349.42952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=NN(C(=C1)C2=NC=C(C=C2)CN)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC(=O)C1=NN(C(=C1)C2=NC=C(C=C2)CN)C3=CC=CC=C3

InChI

InChI=1S/C20H23N5O/c1-20(2,3)23-19(26)17-11-18(16-10-9-14(12-21)13-22-16)25(24-17)15-7-5-4-6-8-15/h4-11,13H,12,21H2,1-3H3,(H,23,26)