3-[1-(4-tert-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-fluorophenyl)prop-2-enenitrile

Systemtic Name: 3-[1-(4-tert-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-fluorophenyl)prop-2-enenitrile Openeye Name: 3-[1-(4-tert-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-fluorophenyl)prop-2-enenitrile CAS Name: 3-[1-(4-tert-butylphenyl)-2,5-dimethyl-3-pyrrolyl]-2-(4-fluorophenyl)-2-propenenitrile IUPAC Name: 3-[1-(4-tert-butylphenyl)-2,5-dimethylpyrrol-3-yl]-2-(4-fluorophenyl)prop-2-enenitrile Traditional Name: 3-[1-(4-tert-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-fluorophenyl)acrylonitrile Formula: C25H25FN2 MolecularWeight: 372.477803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)C(C)(C)C)C)C=C(C#N)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)C(C)(C)C)C)C=C(C#N)C3=CC=C(C=C3)F

InChI

InChI=1S/C25H25FN2/c1-17-14-20(15-21(16-27)19-6-10-23(26)11-7-19)18(2)28(17)24-12-8-22(9-13-24)25(3,4)5/h6-15H,1-5H3