N-[(E)-(4-tert-butylphenyl)methylideneamino]-2-(2-methylphenyl)-5-pyridin-4-yl-pyrazole-3-carboxamide

Systemtic Name: N-[(E)-(4-tert-butylphenyl)methylideneamino]-2-(2-methylphenyl)-5-pyridin-4-yl-pyrazole-3-carboxamide Openeye Name: N-[(E)-(4-tert-butylphenyl)methyleneamino]-2-(o-tolyl)-5-(4-pyridyl)pyrazole-3-carboxamide CAS Name: N-[(E)-(4-tert-butylphenyl)methylideneamino]-2-(2-methylphenyl)-5-pyridin-4-yl-3-pyrazolecarboxamide IUPAC Name: N-[(E)-(4-tert-butylphenyl)methylideneamino]-2-(2-methylphenyl)-5-pyridin-4-ylpyrazole-3-carboxamide Traditional Name: N-[(E)-(4-tert-butylbenzylidene)amino]-2-(o-tolyl)-5-(4-pyridyl)pyrazole-3-carboxamide Formula: C27H27N5O MolecularWeight: 437.53618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=CC(=N2)C3=CC=NC=C3)C(=O)NN=CC4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=CC(=N2)C3=CC=NC=C3)C(=O)N/N=C/C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C27H27N5O/c1-19-7-5-6-8-24(19)32-25(17-23(31-32)21-13-15-28-16-14-21)26(33)30-29-18-20-9-11-22(12-10-20)27(2,3)4/h5-18H,1-4H3,(H,30,33)/b29-18+