4-bromanyl-N-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]-2,5-dimethyl-pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-N-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]-2,5-dimethyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-N-[(E)-(9-ethylcarbazol-3-yl)methyleneamino]-2,5-dimethyl-pyrazole-3-carboxamide CAS Name: 4-bromo-N-[(E)-(9-ethyl-3-carbazolyl)methylideneamino]-2,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]-2,5-dimethylpyrazole-3-carboxamide Traditional Name: 4-bromo-N-[(E)-(9-ethylcarbazol-3-yl)methyleneamino]-2,5-dimethyl-pyrazole-3-carboxamide Formula: C21H20BrN5O MolecularWeight: 438.3204

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C=NNC(=O)C3=C(C(=NN3C)C)Br)C4=CC=CC=C41

Isomeric SMILES

CCN1C2=C(C=C(C=C2)/C=N/NC(=O)C3=C(C(=NN3C)C)Br)C4=CC=CC=C41

InChI

InChI=1S/C21H20BrN5O/c1-4-27-17-8-6-5-7-15(17)16-11-14(9-10-18(16)27)12-23-24-21(28)20-19(22)13(2)25-26(20)3/h5-12H,4H2,1-3H3,(H,24,28)/b23-12+