2-(4-tert-butylphenoxy)-N-[(E)-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]methylideneamino]ethanamide

Systemtic Name: 2-(4-tert-butylphenoxy)-N-[(E)-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]methylideneamino]ethanamide Openeye Name: N-[(E)-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]methyleneamino]-2-(4-tert-butylphenoxy)acetamide CAS Name: 2-(4-tert-butylphenoxy)-N-[(E)-[1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolyl]methylideneamino]acetamide IUPAC Name: N-[(E)-(1-benzyl-3-pyridin-3-ylpyrazol-4-yl)methylideneamino]-2-(4-tert-butylphenoxy)acetamide Traditional Name: N-[(E)-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]methyleneamino]-2-(4-tert-butylphenoxy)acetamide Formula: C28H29N5O2 MolecularWeight: 467.56216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NN=CC2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC(=O)N/N=C/C2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C28H29N5O2/c1-28(2,3)24-11-13-25(14-12-24)35-20-26(34)31-30-17-23-19-33(18-21-8-5-4-6-9-21)32-27(23)22-10-7-15-29-16-22/h4-17,19H,18,20H2,1-3H3,(H,31,34)/b30-17+