5-azanyl-3-[(Z)-2-[3,5-bis(bromanyl)-4-phenylmethoxy-phenyl]-1-cyano-ethenyl]-1-phenyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-3-[(Z)-2-[3,5-bis(bromanyl)-4-phenylmethoxy-phenyl]-1-cyano-ethenyl]-1-phenyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-[(Z)-2-(4-benzyloxy-3,5-dibromo-phenyl)-1-cyano-vinyl]-1-phenyl-pyrazole-4-carbonitrile CAS Name: 5-amino-3-[(Z)-1-cyano-2-(3,5-dibromo-4-phenylmethoxyphenyl)ethenyl]-1-phenyl-4-pyrazolecarbonitrile IUPAC Name: 5-amino-3-[(Z)-1-cyano-2-(3,5-dibromo-4-phenylmethoxyphenyl)ethenyl]-1-phenylpyrazole-4-carbonitrile Traditional Name: 5-amino-3-[(Z)-2-(4-benzoxy-3,5-dibromo-phenyl)-1-cyano-vinyl]-1-phenyl-pyrazole-4-carbonitrile Formula: C26H17Br2N5O MolecularWeight: 575.25408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2Br)C=C(C#N)C3=NN(C(=C3C#N)N)C4=CC=CC=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2Br)/C=C(\C#N)/C3=NN(C(=C3C#N)N)C4=CC=CC=C4)Br

InChI

InChI=1S/C26H17Br2N5O/c27-22-12-18(13-23(28)25(22)34-16-17-7-3-1-4-8-17)11-19(14-29)24-21(15-30)26(31)33(32-24)20-9-5-2-6-10-20/h1-13H,16,31H2/b19-11+