2-azanyl-4-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-6-(4-fluorophenyl)benzene-1,3-dicarbonitrile

Systemtic Name: 2-azanyl-4-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-6-(4-fluorophenyl)benzene-1,3-dicarbonitrile Openeye Name: 2-amino-4-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-6-(4-fluorophenyl)benzene-1,3-dicarbonitrile CAS Name: 2-amino-4-[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]-6-(4-fluorophenyl)benzene-1,3-dicarbonitrile IUPAC Name: 2-amino-4-[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]-6-(4-fluorophenyl)benzene-1,3-dicarbonitrile Traditional Name: 2-amino-4-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-6-(4-fluorophenyl)isophthalonitrile Formula: C29H17ClFN5 MolecularWeight: 489.930183

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)Cl)C4=C(C(=C(C(=C4)C5=CC=C(C=C5)F)C#N)N)C#N

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)Cl)C4=C(C(=C(C(=C4)C5=CC=C(C=C5)F)C#N)N)C#N

InChI

InChI=1S/C29H17ClFN5/c30-20-10-6-19(7-11-20)29-27(17-36(35-29)22-4-2-1-3-5-22)24-14-23(18-8-12-21(31)13-9-18)25(15-32)28(34)26(24)16-33/h1-14,17H,34H2