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

Systemtic Name: 5-azanyl-3-[(Z)-2-[3,5-bis(bromanyl)-2-methoxy-phenyl]-1-cyano-ethenyl]-1-phenyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-[(Z)-1-cyano-2-(3,5-dibromo-2-methoxy-phenyl)vinyl]-1-phenyl-pyrazole-4-carbonitrile CAS Name: 5-amino-3-[(Z)-1-cyano-2-(3,5-dibromo-2-methoxyphenyl)ethenyl]-1-phenyl-4-pyrazolecarbonitrile IUPAC Name: 5-amino-3-[(Z)-1-cyano-2-(3,5-dibromo-2-methoxyphenyl)ethenyl]-1-phenylpyrazole-4-carbonitrile Traditional Name: 5-amino-3-[(Z)-1-cyano-2-(3,5-dibromo-2-methoxy-phenyl)vinyl]-1-phenyl-pyrazole-4-carbonitrile Formula: C20H13Br2N5O MolecularWeight: 499.15812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C=C(C#N)C2=NN(C(=C2C#N)N)C3=CC=CC=C3)Br)Br

Isomeric SMILES

COC1=C(C=C(C=C1/C=C(\C#N)/C2=NN(C(=C2C#N)N)C3=CC=CC=C3)Br)Br

InChI

InChI=1S/C20H13Br2N5O/c1-28-19-12(8-14(21)9-17(19)22)7-13(10-23)18-16(11-24)20(25)27(26-18)15-5-3-2-4-6-15/h2-9H,25H2,1H3/b13-7+