N-[(E)-(3,5-dimethyl-1-pentyl-pyrazol-4-yl)methylideneamino]-3-phenyl-1H-pyrazole-5-carboxamide

Systemtic Name: N-[(E)-(3,5-dimethyl-1-pentyl-pyrazol-4-yl)methylideneamino]-3-phenyl-1H-pyrazole-5-carboxamide Openeye Name: N-[(E)-(3,5-dimethyl-1-pentyl-pyrazol-4-yl)methyleneamino]-3-phenyl-1H-pyrazole-5-carboxamide CAS Name: N-[(E)-(3,5-dimethyl-1-pentyl-4-pyrazolyl)methylideneamino]-3-phenyl-1H-pyrazole-5-carboxamide IUPAC Name: N-[(E)-(3,5-dimethyl-1-pentylpyrazol-4-yl)methylideneamino]-3-phenyl-1H-pyrazole-5-carboxamide Traditional Name: N-[(E)-(1-amyl-3,5-dimethyl-pyrazol-4-yl)methyleneamino]-3-phenyl-1H-pyrazole-5-carboxamide Formula: C21H26N6O MolecularWeight: 378.47074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=C(C(=N1)C)C=NNC(=O)C2=CC(=NN2)C3=CC=CC=C3)C

Isomeric SMILES

CCCCCN1C(=C(C(=N1)C)/C=N/NC(=O)C2=CC(=NN2)C3=CC=CC=C3)C

InChI

InChI=1S/C21H26N6O/c1-4-5-9-12-27-16(3)18(15(2)26-27)14-22-25-21(28)20-13-19(23-24-20)17-10-7-6-8-11-17/h6-8,10-11,13-14H,4-5,9,12H2,1-3H3,(H,23,24)(H,25,28)/b22-14+