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

Systemtic Name: 5-azanyl-3-[(Z)-1-cyano-2-(3-methoxy-4-phenylmethoxy-phenyl)ethenyl]-1-phenyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-[(Z)-2-(4-benzyloxy-3-methoxy-phenyl)-1-cyano-vinyl]-1-phenyl-pyrazole-4-carbonitrile CAS Name: 5-amino-3-[(Z)-1-cyano-2-(3-methoxy-4-phenylmethoxyphenyl)ethenyl]-1-phenyl-4-pyrazolecarbonitrile IUPAC Name: 5-amino-3-[(Z)-1-cyano-2-(3-methoxy-4-phenylmethoxyphenyl)ethenyl]-1-phenylpyrazole-4-carbonitrile Traditional Name: 5-amino-3-[(Z)-2-(4-benzoxy-3-methoxy-phenyl)-1-cyano-vinyl]-1-phenyl-pyrazole-4-carbonitrile Formula: C27H21N5O2 MolecularWeight: 447.48794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C2=NN(C(=C2C#N)N)C3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C#N)/C2=NN(C(=C2C#N)N)C3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H21N5O2/c1-33-25-15-20(12-13-24(25)34-18-19-8-4-2-5-9-19)14-21(16-28)26-23(17-29)27(30)32(31-26)22-10-6-3-7-11-22/h2-15H,18,30H2,1H3/b21-14+