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

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

Systemtic Name:5-azanyl-3-[(Z)-1-cyano-2-[3-ethoxy-4-[2-(3-methylphenoxy)ethoxy]phenyl]ethenyl]-1-phenyl-pyrazole-4-carbonitrile
Openeye Name:5-amino-3-[(Z)-1-cyano-2-[3-ethoxy-4-[2-(3-methylphenoxy)ethoxy]phenyl]vinyl]-1-phenyl-pyrazole-4-carbonitrile
CAS Name:5-amino-3-[(Z)-1-cyano-2-[3-ethoxy-4-[2-(3-methylphenoxy)ethoxy]phenyl]ethenyl]-1-phenyl-4-pyrazolecarbonitrile
IUPAC Name:5-amino-3-[(Z)-1-cyano-2-[3-ethoxy-4-[2-(3-methylphenoxy)ethoxy]phenyl]ethenyl]-1-phenylpyrazole-4-carbonitrile
Traditional Name:5-amino-3-[(Z)-1-cyano-2-[3-ethoxy-4-[2-(3-methylphenoxy)ethoxy]phenyl]vinyl]-1-phenyl-pyrazole-4-carbonitrile
Formula: C30H27N5O3
MolecularWeight: 505.56708
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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C2=NN(C(=C2C#N)N)C3=CC=CC=C3)OCCOC4=CC=CC(=C4)C


Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C2=NN(C(=C2C#N)N)C3=CC=CC=C3)OCCOC4=CC=CC(=C4)C


InChI

InChI=1S/C30H27N5O3/c1-3-36-28-18-22(12-13-27(28)38-15-14-37-25-11-7-8-21(2)16-25)17-23(19-31)29-26(20-32)30(33)35(34-29)24-9-5-4-6-10-24/h4-13,16-18H,3,14-15,33H2,1-2H3/b23-17+


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